| Year |
Citation |
Score |
| 2022 |
Faruk NF, Peng X, Freed KF, Roux B, Sosnick TR. Challenges and Advantages of Accounting for Backbone Flexibility in Prediction of Protein-Protein Complexes. Journal of Chemical Theory and Computation. 18: 2016-2032. PMID 35213808 DOI: 10.1021/acs.jctc.1c01255 |
0.532 |
|
| 2021 |
Peng X, Baxa M, Faruk N, Sachleben JR, Pintscher S, Gagnon IA, Houliston S, Arrowsmith CH, Freed KF, Rocklin GJ, Sosnick TR. Prediction and Validation of a Protein's Free Energy Surface Using Hydrogen Exchange and (Importantly) Its Denaturant Dependence. Journal of Chemical Theory and Computation. PMID 34936354 DOI: 10.1021/acs.jctc.1c00960 |
0.559 |
|
| 2020 |
Sosnick TR, Jumper JM, Wang Z, Peng X, Faruk NF, Freed KF. Upside: Protein Folding in CPU-Hours with Applications to Force-Unfolding of Membrane Proteins Biophysical Journal. 118: 353a. DOI: 10.1016/J.Bpj.2019.11.2034 |
0.772 |
|
| 2020 |
Natesh S, Hummels AR, Sachleben JR, Sosnick TR, Freed KF, Meredith SC, Haddadian EJ. Water Dynamics and Interactions Inside Amyloid-Beta Fibrils Biophysical Journal. 118: 216a. DOI: 10.1016/J.Bpj.2019.11.1284 |
0.512 |
|
| 2019 |
Wang Z, Jumper JM, Freed KF, Sosnick TR. On the Interpretation of Force-Induced Unfolding Studies of Membrane Proteins Using Fast Simulations. Biophysical Journal. PMID 31587831 DOI: 10.1016/J.Bpj.2019.09.011 |
0.785 |
|
| 2019 |
Dudowicz J, Douglas JF, Freed KF. Lattice theory for binding of linear polymers to a solid substrate from polymer melts. II. Influence of van der Waals interactions and chain semiflexibility on molecular binding and adsorption. The Journal of Chemical Physics. 151: 124709. PMID 31575163 DOI: 10.1063/1.5115484 |
0.574 |
|
| 2019 |
Dudowicz J, Douglas JF, Freed KF. Lattice theory for binding of linear polymers to a solid substrate from polymer melts: I. Influence of chain connectivity on molecular binding and adsorption. The Journal of Chemical Physics. 151: 124706. PMID 31575160 DOI: 10.1063/1.5115400 |
0.553 |
|
| 2019 |
Wang Z, Jumper JM, Freed KF, Sosnick TR. Fast, Atomic-Level AFM and Magnetic Tweezers Simulations of the Unfolding of Membrane Proteins using a New Membrane Burial Potential with H-Bonding Biophysical Journal. 116: 300a-301a. DOI: 10.1016/J.Bpj.2018.11.1629 |
0.771 |
|
| 2018 |
Jumper JM, Faruk NF, Freed KF, Sosnick TR. Accurate calculation of side chain packing and free energy with applications to protein molecular dynamics. Plos Computational Biology. 14: e1006342. PMID 30589846 DOI: 10.1371/Journal.Pcbi.1006342 |
0.793 |
|
| 2018 |
Jumper JM, Faruk NF, Freed KF, Sosnick TR. Trajectory-based training enables protein simulations with accurate folding and Boltzmann ensembles in cpu-hours. Plos Computational Biology. 14: e1006578. PMID 30589834 DOI: 10.1371/Journal.Pcbi.1006578 |
0.778 |
|
| 2018 |
Wang Z, Jumper JM, Wang S, Freed KF, Sosnick TR. A Membrane Burial Potential with H-Bonds and Applications to Curved Membranes and Fast Simulations. Biophysical Journal. PMID 30413241 DOI: 10.1016/J.Bpj.2018.10.012 |
0.787 |
|
| 2018 |
Lian H, Qin J, Freed KF. Dielectric virial expansion of polarizable dipolar spheres. The Journal of Chemical Physics. 149: 163332. PMID 30384679 DOI: 10.1063/1.5035551 |
0.305 |
|
| 2018 |
Riback JA, Bowman MA, Zmyslowski A, Knoverek CR, Jumper J, Kaye EB, Freed KF, Clark PL, Sosnick TR. Response to Comment on "Innovative scattering analysis shows that hydrophobic disordered proteins are expanded in water". Science (New York, N.Y.). 361. PMID 30166460 DOI: 10.1126/Science.Aar7949 |
0.751 |
|
| 2018 |
Dudowicz J, Douglas JF, Freed KF. Lattice theory of competitive binding: Influence of van der Waals interactions on molecular binding and adsorption to a solid substrate from binary liquid mixtures. The Journal of Chemical Physics. 149: 044704. PMID 30068175 DOI: 10.1063/1.5040105 |
0.552 |
|
| 2018 |
Riback JA, Bowman MA, Zmyslowski A, Knoverek CR, Jumper JM, Hinshaw J, Kaye EB, Freed KF, Clark PL, Sosnick TR. Measuring the solvent quality of water for disordered proteins from a single SAXS measurement Acta Crystallographica Section a Foundations and Advances. 74: a221-a221. DOI: 10.1107/S0108767318097787 |
0.736 |
|
| 2017 |
Riback JA, Bowman MA, Zmyslowski AM, Knoverek CR, Jumper JM, Hinshaw JR, Kaye EB, Freed KF, Clark PL, Sosnick TR. Innovative scattering analysis shows that hydrophobic disordered proteins are expanded in water. Science (New York, N.Y.). 358: 238-241. PMID 29026044 DOI: 10.1126/Science.Aan5774 |
0.764 |
|
| 2017 |
Dudowicz J, Douglas JF, Freed KF. Mixtures of two self- and mutually-associating liquids: Phase behavior, second virial coefficients, and entropy-enthalpy compensation in the free energy of mixing. The Journal of Chemical Physics. 147: 064909. PMID 28810766 DOI: 10.1063/1.4996921 |
0.555 |
|
| 2017 |
Haddadian EJ, Zhang H, Freed KF, Douglas JF. Comparative Study of the Collective Dynamics of Proteins and Inorganic Nanoparticles. Scientific Reports. 7: 41671. PMID 28176808 DOI: 10.1038/Srep41671 |
0.56 |
|
| 2017 |
Xu W, Douglas JF, Freed KF. Influence of Pressure on Glass Formation in a Simulated Polymer Melt Macromolecules. 50: 2585-2598. DOI: 10.1021/Acs.Macromol.7B00080 |
0.343 |
|
| 2017 |
Riback JA, Bowman MA, Zmyslowski A, Knoverek CR, Jumper J, Hinshaw J, Kaye EB, Freed KF, Clark PL, Sosnick TR. Measuring the (Good) Solvent Quality of Water for Disordered Proteins from a Single SAXS Measurement Biophysical Journal. 112: 316a. DOI: 10.1016/J.Bpj.2016.11.1712 |
0.769 |
|
| 2017 |
Wang S, Wang Z, Jumper J, Freed KF, Sosnick TR, Xu J. Folding Membrane Proteins by Contacts Inferred from Non-Membrane Proteins and Near-Atomic Level Refinement Biophysical Journal. 112: 204a-205a. DOI: 10.1016/J.Bpj.2016.11.1130 |
0.779 |
|
| 2016 |
Xu WS, Douglas JF, Freed KF. Stringlike Cooperative Motion Explains the Influence of Pressure on Relaxation in a Model Glass-Forming Polymer Melt. Acs Macro Letters. 5: 1375-1380. PMID 35651209 DOI: 10.1021/acsmacrolett.6b00795 |
0.525 |
|
| 2016 |
Xu WS, Douglas JF, Freed KF. Generalized entropy theory of glass-formation in fully flexible polymer melts. The Journal of Chemical Physics. 145: 234509. PMID 28010099 DOI: 10.1063/1.4972412 |
0.59 |
|
| 2016 |
Qin J, de Pablo JJ, Freed KF. Image method for induced surface charge from many-body system of dielectric spheres. The Journal of Chemical Physics. 145: 124903. PMID 27782617 DOI: 10.1063/1.4962832 |
0.302 |
|
| 2016 |
Virtanen JJ, Sosnick TR, Freed KF. Erratum: "Ionic strength independence of charge distributions in solvation of biomolecules" [J. Chem. Phys. 141, 22D503 (2014)]. The Journal of Chemical Physics. 145: 059903. PMID 27497583 DOI: 10.1063/1.4959170 |
0.723 |
|
| 2016 |
Xu WS, Freed KF. Self-assembly and glass-formation in a lattice model of telechelic polymer melts: Influence of stiffness of the sticky bonds. The Journal of Chemical Physics. 144: 214903. PMID 27276966 DOI: 10.1063/1.4952979 |
0.359 |
|
| 2016 |
Dudowicz JB, Freed KF, Douglas JF. Relation Between Solvent Quality and Phase Behavior of Ternary Mixtures of Polymers and Two Solvents that Exhibit Cononsolvency. The Journal of Physical Chemistry. B. PMID 27253170 DOI: 10.1021/Acs.Jpcb.6B03248 |
0.565 |
|
| 2016 |
Yu W, Baxa MC, Gagnon I, Freed KF, Sosnick TR. Cooperative folding near the downhill limit determined with amino acid resolution by hydrogen exchange. Proceedings of the National Academy of Sciences of the United States of America. PMID 27078098 DOI: 10.1073/Pnas.1522500113 |
0.507 |
|
| 2016 |
Xu W, Douglas JF, Freed KF. Stringlike Cooperative Motion Explains the Influence of Pressure on Relaxation in a Model Glass-Forming Polymer Melt Acs Macro Letters. 5: 1375-1380. DOI: 10.1021/Acsmacrolett.6B00795 |
0.346 |
|
| 2016 |
Xu W, Douglas JF, Freed KF. Influence of Cohesive Energy on Relaxation in a Model Glass-Forming Polymer Melt Macromolecules. 49: 8355-8370. DOI: 10.1021/Acs.Macromol.6B01504 |
0.358 |
|
| 2016 |
Xu W, Douglas JF, Freed KF. Influence of Cohesive Energy on the Thermodynamic Properties of a Model Glass-Forming Polymer Melt Macromolecules. 49: 8341-8354. DOI: 10.1021/Acs.Macromol.6B01503 |
0.374 |
|
| 2016 |
Wang Z, Jumper JM, Freed KF, Sosnick TR. Including H-Bonding in Depth-Dependent Membrane Burial Potentials for Improving Folding Simulations Biophysical Journal. 110: 58a. DOI: 10.1016/J.Bpj.2015.11.378 |
0.788 |
|
| 2016 |
Natesh SR, Meredith SC, Sosnick TR, Freed KF, Haddadian EJ. Aβ Fibrils Act as Aqueous Pores: A Molecular Dynamics Study Biophysical Journal. 110: 553a. DOI: 10.1016/J.Bpj.2015.11.2959 |
0.547 |
|
| 2016 |
Sosnick TR, Jumper JM, Freed KF. Upside: A New Dynamics Method Capable of Cooperative De Novo Protein Folding in CPU-Hours Biophysical Journal. 110: 523a-524a. DOI: 10.1016/J.Bpj.2015.11.2801 |
0.778 |
|
| 2015 |
Dudowicz J, Freed KF, Douglas JF. Phase behavior and second osmotic virial coefficient for competitive polymer solvation in mixed solvent solutions. The Journal of Chemical Physics. 143: 194901. PMID 26590552 DOI: 10.1063/1.4935705 |
0.577 |
|
| 2015 |
Dudowicz J, Freed KF, Douglas JF. Communication: Cosolvency and cononsolvency explained in terms of a Flory-Huggins type theory. The Journal of Chemical Physics. 143: 131101. PMID 26450285 DOI: 10.1063/1.4932061 |
0.58 |
|
| 2015 |
Freed KF. Communication: The simplified generalized entropy theory of glass-formation in polymer melts. The Journal of Chemical Physics. 143: 051102. PMID 26254633 DOI: 10.1063/1.4927766 |
0.372 |
|
| 2015 |
Xu WS, Freed KF. Lattice model of linear telechelic polymer melts. II. Influence of chain stiffness on basic thermodynamic properties. The Journal of Chemical Physics. 143: 024902. PMID 26178122 DOI: 10.1063/1.4926359 |
0.35 |
|
| 2015 |
Xu WS, Freed KF. Lattice model of linear telechelic polymer melts. I. Inclusion of chain semiflexibility in the lattice cluster theory. The Journal of Chemical Physics. 143: 024901. PMID 26178121 DOI: 10.1063/1.4926358 |
0.373 |
|
| 2015 |
Baxa MC, Yu W, Adhikari AN, Ge L, Xia Z, Zhou R, Freed KF, Sosnick TR. Even with nonnative interactions, the updated folding transition states of the homologs Proteins G & L are extensive and similar. Proceedings of the National Academy of Sciences of the United States of America. PMID 26100906 DOI: 10.1073/Pnas.1503613112 |
0.792 |
|
| 2015 |
Dudowicz J, Freed KF, Douglas JF. Theory of competitive solvation of polymers by two solvents and entropy-enthalpy compensation in the solvation free energy upon dilution with the second solvent. The Journal of Chemical Physics. 142: 214906. PMID 26049523 DOI: 10.1063/1.4921373 |
0.551 |
|
| 2015 |
Dudowicz J, Douglas JF, Freed KF. The meaning of the "universal" WLF parameters of glass-forming polymer liquids. The Journal of Chemical Physics. 142: 014905. PMID 25573581 DOI: 10.1063/1.4905216 |
0.478 |
|
| 2015 |
Xu WS, Freed KF. Generalized entropy theory of glass formation in polymer melts with specific interactions Macromolecules. 48: 2333-2343. DOI: 10.1021/Acs.Macromol.5B00144 |
0.377 |
|
| 2014 |
Dudowicz J, Douglas JF, Freed KF. Advances in the generalized entropy theory of glass-formation in polymer melts. The Journal of Chemical Physics. 141: 234903. PMID 25527959 DOI: 10.1063/1.4903842 |
0.517 |
|
| 2014 |
Virtanen JJ, Sosnick TR, Freed KF. Ionic strength independence of charge distributions in solvation of biomolecules. The Journal of Chemical Physics. 141: 22D503. PMID 25494774 DOI: 10.1063/1.4895522 |
0.754 |
|
| 2014 |
Skinner JJ, Yu W, Gichana EK, Baxa MC, Hinshaw JR, Freed KF, Sosnick TR. Benchmarking all-atom simulations using hydrogen exchange. Proceedings of the National Academy of Sciences of the United States of America. 111: 15975-80. PMID 25349413 DOI: 10.1073/Pnas.1404213111 |
0.591 |
|
| 2014 |
Freed KF. Communication: Towards first principles theory of relaxation in supercooled liquids formulated in terms of cooperative motion. The Journal of Chemical Physics. 141: 141102. PMID 25318708 DOI: 10.1063/1.4897973 |
0.354 |
|
| 2014 |
Baxa MC, Haddadian EJ, Jumper JM, Freed KF, Sosnick TR. Loss of conformational entropy in protein folding calculated using realistic ensembles and its implications for NMR-based calculations. Proceedings of the National Academy of Sciences of the United States of America. 111: 15396-401. PMID 25313044 DOI: 10.1073/Pnas.1407768111 |
0.779 |
|
| 2014 |
Xu WS, Freed KF. Lattice cluster theory for polymer melts with specific interactions. The Journal of Chemical Physics. 141: 044909. PMID 25084958 DOI: 10.1063/1.4890959 |
0.399 |
|
| 2014 |
Freed KF. Perturbative many-body expansion for electrostatic energy and field for system of polarizable charged spherical ions in a dielectric medium. The Journal of Chemical Physics. 141: 034115. PMID 25053309 DOI: 10.1063/1.4890077 |
0.318 |
|
| 2014 |
Dudowicz J, Douglas JF, Freed KF. Two glass transitions in miscible polymer blends? The Journal of Chemical Physics. 140: 244905. PMID 24985676 DOI: 10.1063/1.4884123 |
0.589 |
|
| 2014 |
Dudowicz J, Freed KF, Douglas JF. Concentration fluctuations in miscible polymer blends: influence of temperature and chain rigidity. The Journal of Chemical Physics. 140: 194901. PMID 24852557 DOI: 10.1063/1.4875345 |
0.571 |
|
| 2014 |
Xu WS, Freed KF. Influence of cohesive energy and chain stiffness on polymer glass formation Macromolecules. 47: 6990-6997. DOI: 10.1021/Ma501581U |
0.374 |
|
| 2014 |
Johnson KW, Sosnick TR, Freed KF, Haddadian EJ. Differences in Dynamics and Stability of the Wild Type Beta-Amyloid Aβ1-40, and ΔE22-Aβ1-39 (Japanese) Mutant Protofibril Structures, a Molecular Dynamics Study Biophysical Journal. 106: 482a. DOI: 10.1016/J.Bpj.2013.11.2722 |
0.547 |
|
| 2013 |
Freed KF. Phase field method for nonequilibrium dynamics of reversible self-assembly systems. The Journal of Chemical Physics. 139: 134904. PMID 24116582 DOI: 10.1063/1.4822304 |
0.308 |
|
| 2013 |
Liu Y, Haddadian E, Sosnick TR, Freed KF, Gong H. A novel implicit solvent model for simulating the molecular dynamics of RNA. Biophysical Journal. 105: 1248-57. PMID 24010668 DOI: 10.1016/J.Bpj.2013.07.033 |
0.731 |
|
| 2013 |
Adhikari AN, Freed KF, Sosnick TR. Simplified protein models: predicting folding pathways and structure using amino acid sequences. Physical Review Letters. 111: 028103. PMID 23889448 DOI: 10.1103/Physrevlett.111.028103 |
0.799 |
|
| 2013 |
Xu WS, Freed KF. Thermodynamic scaling of dynamics in polymer melts: predictions from the generalized entropy theory. The Journal of Chemical Physics. 138: 234501. PMID 23802965 DOI: 10.1063/1.4809991 |
0.359 |
|
| 2013 |
Dudowicz J, Freed KF, Douglas JF. Solvation of polymers as mutual association. II. Basic thermodynamic properties Journal of Chemical Physics. 138. PMID 23635166 DOI: 10.1063/1.4800082 |
0.588 |
|
| 2013 |
Dudowicz J, Freed KF, Douglas JF. Solvation of polymers as mutual association. I. General theory Journal of Chemical Physics. 138. PMID 23635165 DOI: 10.1063/1.4800074 |
0.599 |
|
| 2013 |
Chaudhuri RK, Freed KF, Chattopadhyay S, Mahapatra US. Theoretical studies of the ground and excited state structures of stilbene. The Journal of Physical Chemistry. A. 117: 9424-34. PMID 23530611 DOI: 10.1021/Jp311493W |
0.304 |
|
| 2013 |
Adhikari AN, Freed KF, Sosnick TR. Simplified protein models: Predicting folding pathways and structure using amino acid sequences Physical Review Letters. 111. DOI: 10.1103/PhysRevLett.111.028103 |
0.482 |
|
| 2013 |
Wang Z, Freed K, Haddadian EJ. The Differences in Dynamics and Stability of the Wild Type Beta-Amyloid Aβ1-40, and ΔE22-Aβ1-39 (Japanese) Mutant, a Molecular Dynamics Study Biophysical Journal. 104: 398a-399a. DOI: 10.1016/J.Bpj.2012.11.2223 |
0.775 |
|
| 2012 |
Adhikari AN, Freed KF, Sosnick TR. De novo prediction of protein folding pathways and structure using the principle of sequential stabilization. Proceedings of the National Academy of Sciences of the United States of America. 109: 17442-7. PMID 23045636 DOI: 10.1073/Pnas.1209000109 |
0.791 |
|
| 2012 |
Baxa MC, Haddadian EJ, Jha AK, Freed KF, Sosnick TR. Context and force field dependence of the loss of protein backbone entropy upon folding using realistic denatured and native state ensembles. Journal of the American Chemical Society. 134: 15929-36. PMID 22928488 DOI: 10.1021/Ja3064028 |
0.679 |
|
| 2012 |
Dudowicz J, Freed KF, Douglas JF. Lattice cluster theory of associating polymers. IV. Phase behavior of telechelic polymer solutions. The Journal of Chemical Physics. 136: 194903. PMID 22612112 DOI: 10.1063/1.4714563 |
0.579 |
|
| 2012 |
Dudowicz J, Freed KF, Douglas JF. Lattice cluster theory of associating telechelic polymers. III. Order parameter and average degree of self-assembly, transition temperature, and specific heat. The Journal of Chemical Physics. 136: 194902. PMID 22612111 DOI: 10.1063/1.4714562 |
0.582 |
|
| 2012 |
Yoo TY, Adhikari A, Xia Z, Huynh T, Freed KF, Zhou R, Sosnick TR. The folding transition state of protein L is extensive with nonnative interactions (and not small and polarized). Journal of Molecular Biology. 420: 220-34. PMID 22522126 DOI: 10.1016/J.Jmb.2012.04.013 |
0.795 |
|
| 2012 |
Parisien M, Freed KF, Sosnick TR. On docking, scoring and assessing protein-DNA complexes in a rigid-body framework. Plos One. 7: e32647. PMID 22393431 DOI: 10.1371/Journal.Pone.0032647 |
0.554 |
|
| 2012 |
Dudowicz J, Freed KF, Douglas JF. Lattice cluster theory of associating polymers. II. Enthalpy and entropy of self-assembly and Flory-Huggins interaction parameter χ for solutions of telechelic molecules. The Journal of Chemical Physics. 136: 064903. PMID 22360220 DOI: 10.1063/1.3681256 |
0.58 |
|
| 2012 |
Dudowicz J, Freed KF. Lattice cluster theory of associating polymers. I. Solutions of linear telechelic polymer chains Journal of Chemical Physics. 136. PMID 22360219 DOI: 10.1063/1.3681257 |
0.376 |
|
| 2012 |
Adhikari AN, Peng J, Wilde M, Xu J, Freed KF, Sosnick TR. Modeling large regions in proteins: applications to loops, termini, and folding. Protein Science : a Publication of the Protein Society. 21: 107-21. PMID 22095743 DOI: 10.1002/Pro.767 |
0.79 |
|
| 2012 |
Chaudhuri RK, Freed KF, Chattopadhyay S, Mahapatra US. Theoretical aids in screening candidates for atomic clocks: Illustration for Yb II Epl. 98. DOI: 10.1209/0295-5075/98/23002 |
0.323 |
|
| 2012 |
Dudowicz J, Freed KF, Douglas JF. Can the miscibility of telechelic polymer solutions increase with polymer chain length? Acs Macro Letters. 1: 88-91. DOI: 10.1021/Mz200101P |
0.33 |
|
| 2012 |
Debartolo J, Jha A, Freed KF, Sosnick TR. Local Backbone Preferences and Nearest-Neighbor Effects in the Unfolded and Native States Protein and Peptide Folding, Misfolding, and Non-Folding. 79-98. DOI: 10.1002/9781118183373.ch3 |
0.614 |
|
| 2011 |
Dudowicz J, Freed KF, Douglas JF. Can the Miscibility of Telechelic Polymer Solutions Increase with Polymer Chain Length? Acs Macro Letters. 1: 88-91. PMID 35578460 DOI: 10.1021/mz200101p |
0.505 |
|
| 2011 |
Freed KF, Wu C. General approach to polymer chains confined by interacting boundaries. II. Flow through a cylindrical nano-tube. The Journal of Chemical Physics. 135: 144902. PMID 22010730 DOI: 10.1063/1.3646959 |
0.364 |
|
| 2011 |
Virtanen JJ, Makowski L, Sosnick TR, Freed KF. Modeling the hydration layer around proteins: applications to small- and wide-angle x-ray scattering. Biophysical Journal. 101: 2061-9. PMID 22004761 DOI: 10.1016/J.Bpj.2011.09.021 |
0.763 |
|
| 2011 |
Chaudhuri RK, Freed KF, Chattopadhyay S, Mahapatra US. Application of an efficient multireference approach to free-base porphin and metalloporphyrins: ground, excited, and positive ion states. The Journal of Chemical Physics. 135: 084118. PMID 21895170 DOI: 10.1063/1.3627153 |
0.337 |
|
| 2011 |
Haddadian EJ, Gong H, Jha AK, Yang X, Debartolo J, Hinshaw JR, Rice PA, Sosnick TR, Freed KF. Automated real-space refinement of protein structures using a realistic backbone move set. Biophysical Journal. 101: 899-909. PMID 21843481 DOI: 10.1016/J.Bpj.2011.06.063 |
0.771 |
|
| 2011 |
Chattopadhyay S, Chaudhuri RK, Freed KF. Prediction of electronic structure of organic radicaloid anions using efficient, economical multireference gradient approach. Physical Chemistry Chemical Physics : Pccp. 13: 7514-23. PMID 21423953 DOI: 10.1039/C0Cp02106G |
0.349 |
|
| 2011 |
Freed KF. The descent into glass formation in polymer fluids. Accounts of Chemical Research. 44: 194-203. PMID 21207948 DOI: 10.1021/Ar100122W |
0.335 |
|
| 2011 |
Chattopadhyay S, Chaudhuri RK, Freed KF. Geometry optimization of radicaloid systems using improved virtual orbital-complete active space configuration interaction (IVO-CASCI) analytical gradient method Journal of Physical Chemistry A. 115: 3665-3678. PMID 20586459 DOI: 10.1021/Jp103536W |
0.343 |
|
| 2011 |
Freed KF, Wu C. Comparison of calculated and measured critical flow rates for dragging linear polymer chains through a small cylindrical tube Macromolecules. 44: 9863-9866. DOI: 10.1021/Ma202071B |
0.351 |
|
| 2010 |
Freed KF, Dudowicz J, Stukalin EB, Douglas JF. General approach to polymer chains confined by interacting boundaries. The Journal of Chemical Physics. 133: 094901. PMID 20831332 DOI: 10.1063/1.3475520 |
0.582 |
|
| 2010 |
Virtanen JJ, Makowski L, Sosnick TR, Freed KF. Modeling the hydration layer around proteins: HyPred. Biophysical Journal. 99: 1611-9. PMID 20816074 DOI: 10.1016/J.Bpj.2010.06.027 |
0.759 |
|
| 2010 |
Zhao F, Peng J, Debartolo J, Freed KF, Sosnick TR, Xu J. A probabilistic and continuous model of protein conformational space for template-free modeling. Journal of Computational Biology : a Journal of Computational Molecular Cell Biology. 17: 783-98. PMID 20583926 DOI: 10.1089/Cmb.2009.0235 |
0.575 |
|
| 2010 |
Stukalin EB, Douglas JF, Freed KF. Plasticization and antiplasticization of polymer melts diluted by low molar mass species. The Journal of Chemical Physics. 132: 084504. PMID 20192304 DOI: 10.1063/1.3304738 |
0.594 |
|
| 2010 |
Baird NJ, Gong H, Zaheer SS, Freed KF, Pan T, Sosnick TR. Extended structures in RNA folding intermediates are due to nonnative interactions rather than electrostatic repulsion. Journal of Molecular Biology. 397: 1298-306. PMID 20188108 DOI: 10.1016/J.Jmb.2010.02.025 |
0.732 |
|
| 2010 |
Gong H, Freed KF. Electrostatic solvation energy for two oppositely charged Ions in a solvated protein system: Salt bridges can stabilize proteins Biophysical Journal. 98: 470-477. PMID 20141761 DOI: 10.1016/J.Bpj.2009.10.031 |
0.689 |
|
| 2010 |
Chaudhuri RK, Chattopadhyay S, Mahapatra US, Freed KF. Molecular applications of analytical gradient approach for the improved virtual orbital-complete active space configuration interaction method. The Journal of Chemical Physics. 132: 034105. PMID 20095726 DOI: 10.1063/1.3290203 |
0.359 |
|
| 2010 |
DeBartolo J, Hocky G, Wilde M, Xu J, Freed KF, Sosnick TR. Protein structure prediction enhanced with evolutionary diversity: SPEED. Protein Science : a Publication of the Protein Society. 19: 520-34. PMID 20066664 DOI: 10.1002/Pro.330 |
0.748 |
|
| 2010 |
Hayes D, Panitchayangkoon G, Fransted KA, Caram JR, Wen J, Freed KF, Engel GS. Dynamics of electronic dephasing in the Fenna-Matthews-Olson complex New Journal of Physics. 12. DOI: 10.1088/1367-2630/12/6/065042 |
0.655 |
|
| 2009 |
Zhao F, Peng J, Debartolo J, Freed KF, Sosnick TR, Xu J. A Probabilistic Graphical Model for Ab Initio Folding. Research in Computational Molecular Biology : ... Annual International Conference, Recomb ... : Proceedings. Recomb (Conference : 2005-). 5541: 59-73. PMID 23459639 DOI: 10.1007/978-3-642-02008-7_5 |
0.539 |
|
| 2009 |
Douglas JF, Dudowicz J, Freed KF. Crowding induced self-assembly and enthalpy-entropy compensation. Physical Review Letters. 103: 135701. PMID 19905522 DOI: 10.1103/Physrevlett.103.135701 |
0.557 |
|
| 2009 |
Stukalin EB, Douglas JF, Freed KF. Application of the entropy theory of glass formation to poly(alpha-olefins). The Journal of Chemical Physics. 131: 114905. PMID 19778147 DOI: 10.1063/1.3216109 |
0.555 |
|
| 2009 |
Dudowicz J, Douglas JF, Freed KF. An exactly solvable model of hierarchical self-assembly Journal of Chemical Physics. 130. PMID 19530788 DOI: 10.1063/1.3148893 |
0.53 |
|
| 2009 |
Dudowicz J, Douglas JF, Freed KF. Equilibrium polymerization models of re-entrant self-assembly. The Journal of Chemical Physics. 130: 164905. PMID 19405628 DOI: 10.1063/1.3118671 |
0.512 |
|
| 2009 |
Gong H, Freed KF. Langevin-Debye model for nonlinear electrostatic screening of solvated ions. Physical Review Letters. 102: 057603. PMID 19257555 DOI: 10.1103/Physrevlett.102.057603 |
0.626 |
|
| 2009 |
Dudowicz J, Douglas JF, Freed KF. Competition between self-assembly and surface adsorption Journal of Chemical Physics. 130. PMID 19256623 DOI: 10.1063/1.3077866 |
0.496 |
|
| 2009 |
Baxa MC, Freed KF, Sosnick TR. Psi-constrained simulations of protein folding transition states: implications for calculating. Journal of Molecular Biology. 386: 920-8. PMID 19244613 DOI: 10.1016/J.Jmb.2009.01.010 |
0.559 |
|
| 2009 |
DeBartolo J, Colubri A, Jha AK, Fitzgerald JE, Freed KF, Sosnick TR. Mimicking the folding pathway to improve homology-free protein structure prediction. Proceedings of the National Academy of Sciences of the United States of America. 106: 3734-9. PMID 19237560 DOI: 10.1073/Pnas.0811363106 |
0.669 |
|
| 2009 |
Freed KF. Extension of lattice cluster theory to strongly interacting, self-assembling polymeric systems. The Journal of Chemical Physics. 130: 061103. PMID 19222258 DOI: 10.1063/1.3078516 |
0.37 |
|
| 2009 |
Dudowicz J, Douglas JF, Freed KF. Self-assembly in a polymer matrix and its impact on phase separation. The Journal of Physical Chemistry. B. 113: 3920-31. PMID 19006266 DOI: 10.1021/Jp805829K |
0.565 |
|
| 2009 |
Baxa MC, Freed KF, Sosnick TR. Investigating the Origins of Fractional ψ-values in Protein Folding Transition States Biophysical Journal. 96: 78a. DOI: 10.1016/J.Bpj.2008.12.305 |
0.572 |
|
| 2009 |
Sheppard MG, Freed KF. Third-order quasidegenerate many-body perturbation theory calculations for valence state correlation energies of the nitrogen and oxygen atoms and their ions International Journal of Quantum Chemistry. 20: 21-31. DOI: 10.1002/Qua.560200804 |
0.323 |
|
| 2008 |
Dudowicz J, Douglas JF, Freed KF. Self-assembly by mutual association: basic thermodynamic properties. The Journal of Physical Chemistry. B. 112: 16193-204. PMID 19367924 DOI: 10.1021/Jp806859W |
0.551 |
|
| 2008 |
Stukalin EB, Douglas JF, Freed KF. Multistep relaxation in equilibrium polymer solutions: a minimal model of relaxation in "complex" fluids. The Journal of Chemical Physics. 129: 094901. PMID 19044888 DOI: 10.1063/1.2976341 |
0.58 |
|
| 2008 |
Chaudhuri RK, Hammond JR, Freed KF, Chattopadhyay S, Mahapatra US. Reappraisal of cis effect in 1,2-dihaloethenes: an improved virtual orbital multireference approach. The Journal of Chemical Physics. 129: 064101. PMID 18715045 DOI: 10.1063/1.2958284 |
0.591 |
|
| 2008 |
Chaudhuri RK, Freed KF. Improved virtual orbital multireference Møller-Plesset study of the ground and excited electronic states of protonated acetylene, C2H3+. The Journal of Chemical Physics. 129: 054308. PMID 18698901 DOI: 10.1063/1.2958282 |
0.348 |
|
| 2008 |
Gong H, Hocky G, Freed KF. Influence of nonlinear electrostatics on transfer energies between liquid phases: Charge burial is far less expensive than Born model Proceedings of the National Academy of Sciences of the United States of America. 105: 11146-11151. PMID 18678891 DOI: 10.1073/Pnas.0804506105 |
0.793 |
|
| 2008 |
Baxa MC, Freed KF, Sosnick TR. Quantifying the structural requirements of the folding transition state of protein A and other systems. Journal of Molecular Biology. 381: 1362-81. PMID 18625237 DOI: 10.1016/J.Jmb.2008.06.067 |
0.598 |
|
| 2008 |
Douglas JF, Dudowicz J, Freed KF. Lattice model of equilibrium polymerization. VII. Understanding the role of "cooperativity" in self-assembly. The Journal of Chemical Physics. 128: 224901. PMID 18554047 DOI: 10.1063/1.2909195 |
0.525 |
|
| 2008 |
Chaudhuri RK, Freed KF, Chattopadhyay S, Sinha Mahapatra U. Potential energy curve for isomerization of N2H2 and C2H4 using the improved virtual orbital multireference Møller-Plesset perturbation theory. The Journal of Chemical Physics. 128: 144304. PMID 18412442 DOI: 10.1063/1.2837662 |
0.373 |
|
| 2008 |
Kent A, Jha AK, Fitzgerald JE, Freed KF. Benchmarking implicit solvent folding simulations of the amyloid β(10-35) fragment Journal of Physical Chemistry B. 112: 6175-6186. PMID 18348560 DOI: 10.1021/Jp077099H |
0.565 |
|
| 2008 |
Jha AK, Freed KF. Solvation effect on conformations of 1,2:dimethoxyethane: Charge-dependent nonlinear response in implicit solvent models Journal of Chemical Physics. 128. PMID 18205504 DOI: 10.1063/1.2815764 |
0.563 |
|
| 2007 |
Douglas JF, Dudowicz J, Freed KF. Lattice model of equilibrium polymerization. VI. Measures of fluid "complexity" and search for generalized corresponding states. The Journal of Chemical Physics. 127: 224901. PMID 18081420 DOI: 10.1063/1.2785187 |
0.562 |
|
| 2007 |
Fitzgerald JE, Jha AK, Colubri A, Sosnick TR, Freed KF. Reduced C(beta) statistical potentials can outperform all-atom potentials in decoy identification. Protein Science : a Publication of the Protein Society. 16: 2123-39. PMID 17893359 DOI: 10.1110/Ps.072939707 |
0.67 |
|
| 2007 |
Chaudhuri RK, Freed KF. Geometry optimization using improved virtual orbitals: a complete active space numerical gradient approach. The Journal of Chemical Physics. 126: 114103. PMID 17381192 DOI: 10.1063/1.2566692 |
0.334 |
|
| 2007 |
Artyomov MN, Freed KF. Actin polymerization under pressure: a theoretical study. The Journal of Chemical Physics. 126: 024908. PMID 17228974 DOI: 10.1063/1.2409928 |
0.303 |
|
| 2007 |
Fitzgerald JE, Jha AK, Sosnick TR, Freed KF. Polypeptide motions are dominated by peptide group oscillations resulting from dihedral angle correlations between nearest neighbors. Biochemistry. 46: 669-82. PMID 17223689 DOI: 10.1021/Bi061575X |
0.655 |
|
| 2007 |
Singer SJ, Freed KF, Band YB. Photodissociation of Diatomic Molecules to Open Shell Atoms Advances in Chemical Physics. 61: 1-113. DOI: 10.1002/9780470142851.Ch1 |
0.518 |
|
| 2006 |
Stukalin EB, Freed KF. Minimal model of relaxation in an associating fluid: viscoelastic and dielectric relaxations in equilibrium polymer solutions. The Journal of Chemical Physics. 125: 184905. PMID 17115793 DOI: 10.1063/1.2378648 |
0.354 |
|
| 2006 |
Douglas JF, Dudowicz J, Freed KF. Does equilibrium polymerization describe the dynamic heterogeneity of glass-forming liquids? The Journal of Chemical Physics. 125: 144907. PMID 17042650 DOI: 10.1063/1.2356863 |
0.566 |
|
| 2006 |
Colubri A, Jha AK, Shen MY, Sali A, Berry RS, Sosnick TR, Freed KF. Minimalist representations and the importance of nearest neighbor effects in protein folding simulations. Journal of Molecular Biology. 363: 835-57. PMID 16982067 DOI: 10.1016/J.Jmb.2006.08.035 |
0.757 |
|
| 2006 |
Pandit AD, Jha A, Freed KF, Sosnick TR. Small proteins fold through transition states with native-like topologies. Journal of Molecular Biology. 361: 755-70. PMID 16876194 DOI: 10.1016/J.Jmb.2006.06.041 |
0.687 |
|
| 2006 |
Rah K, Freed KF, Dudowicz J, Douglas JF. Lattice model of equilibrium polymerization. V. Scattering properties and the width of the critical regime for phase separation. The Journal of Chemical Physics. 124: 144906. PMID 16626244 DOI: 10.1063/1.2181138 |
0.576 |
|
| 2006 |
Dudowicz J, Freed KF, Douglas JF. Entropy theory of polymer glass formation revisited. I. General formulation. The Journal of Chemical Physics. 124: 64901. PMID 16483238 DOI: 10.1063/1.2166391 |
0.591 |
|
| 2006 |
Chaudhuri RK, Krishnamachari SLNG, Freed KF. Ab initio description of the ground and excited states of cyanogen isomers Journal of Molecular Structure: Theochem. 768: 119-126. DOI: 10.1016/J.Theochem.2006.05.019 |
0.318 |
|
| 2005 |
Dudowicz J, Freed KF, Douglas JF. Fragility of glass-forming polymer liquids. The Journal of Physical Chemistry. B. 109: 21350-6. PMID 16853769 DOI: 10.1021/Jp053693K |
0.59 |
|
| 2005 |
Dudowicz J, Freed KF, Douglas JF. The glass transition temperature of polymer melts. The Journal of Physical Chemistry. B. 109: 21285-92. PMID 16853759 DOI: 10.1021/Jp0523266 |
0.57 |
|
| 2005 |
Dudowicz J, Freed KF, Douglas JF. Direct computation of characteristic temperatures and relaxation times for glass-forming polymer liquids. The Journal of Chemical Physics. 123: 111102. PMID 16392543 DOI: 10.1063/1.2035087 |
0.568 |
|
| 2005 |
Artyomov MN, Freed KF. Compressible models of equilibrium polymerization. The Journal of Chemical Physics. 123: 194906. PMID 16321112 DOI: 10.1063/1.2117047 |
0.375 |
|
| 2005 |
Jha AK, Colubri A, Freed KF, Sosnick TR. Statistical coil model of the unfolded state: resolving the reconciliation problem. Proceedings of the National Academy of Sciences of the United States of America. 102: 13099-104. PMID 16131545 DOI: 10.1073/Pnas.0506078102 |
0.68 |
|
| 2005 |
Jha AK, Colubri A, Zaman MH, Koide S, Sosnick TR, Freed KF. Helix, sheet, and polyproline II frequencies and strong nearest neighbor effects in a restricted coil library. Biochemistry. 44: 9691-702. PMID 16008354 DOI: 10.1021/Bi0474822 |
0.646 |
|
| 2005 |
Chaudhuri RK, Freed KF. Relativistic effective valence shell Hamiltonian method: excitation and ionization energies of heavy metal atoms. The Journal of Chemical Physics. 122: 204111. PMID 15945717 DOI: 10.1063/1.1906206 |
0.319 |
|
| 2005 |
Chaudhuri RK, Freed KF. Generation of potential energy curves for the X1Sigma(+)g, B1Delta(+)g, and B'1Sigma(+)g states of C2 using the effective valence shell Hamiltonian method. The Journal of Chemical Physics. 122: 154310. PMID 15945638 DOI: 10.1063/1.1879812 |
0.347 |
|
| 2005 |
Chaudhuri RK, Freed KF, Hose G, Piecuch P, Kowalski K, W?och M, Chattopadhyay S, Mukherjee D, Rolik Z, Szabados A, Tóth G, Surján PR. Comparison of low-order multireference many-body perturbation theories. The Journal of Chemical Physics. 122: 134105. PMID 15847453 DOI: 10.1063/1.1863912 |
0.544 |
|
| 2005 |
Shen MY, Freed KF. A simple method for faster nonbonded force evaluations. Journal of Computational Chemistry. 26: 691-8. PMID 15754302 DOI: 10.1002/Jcc.20211 |
0.596 |
|
| 2005 |
Taylor CM, Chaudhuri RK, Freed KF. Electronic structure of the calcium monohydroxide radical. The Journal of Chemical Physics. 122: 44317. PMID 15740258 DOI: 10.1063/1.1834511 |
0.31 |
|
| 2005 |
Perrine TM, Chaudhuri RK, Freed KF. Quadratic Padé approximants and the intruder state problem of multireference perturbation methods International Journal of Quantum Chemistry. 105: 18-33. DOI: 10.1002/Qua.20648 |
0.795 |
|
| 2004 |
Seok C, Freed KF, Szleifer I. Analytic density-functional self-consistent-field theory of diblock copolymers near patterned surfaces. The Journal of Chemical Physics. 120: 7174-82. PMID 15267625 DOI: 10.1063/1.1669372 |
0.637 |
|
| 2004 |
Buta D, Freed KF. Mixtures of lattice polymers with structured monomers. The Journal of Chemical Physics. 120: 6288-98. PMID 15267516 DOI: 10.1063/1.1652432 |
0.804 |
|
| 2004 |
Dudowicz J, Freed KF, Douglas JF. Flory-Huggins model of equilibrium polymerization and phase separation in the Stockmayer fluid. Physical Review Letters. 92: 045502. PMID 14995384 DOI: 10.1103/Physrevlett.92.045502 |
0.545 |
|
| 2003 |
Zaman MH, Shen MY, Berry RS, Freed KF, Sosnick TR. Investigations into sequence and conformational dependence of backbone entropy, inter-basin dynamics and the Flory isolated-pair hypothesis for peptides. Journal of Molecular Biology. 331: 693-711. PMID 12899838 DOI: 10.1016/S0022-2836(03)00765-4 |
0.683 |
|
| 2003 |
Cui B, Shen MY, Freed KF. Folding and misfolding of the papillomavirus E6 interacting peptide E6ap. Proceedings of the National Academy of Sciences of the United States of America. 100: 7087-92. PMID 12771374 DOI: 10.1073/Pnas.0431214100 |
0.573 |
|
| 2003 |
Fernández A, Shen MY, Colubri A, Sosnick TR, Berry RS, Freed KF. Large-scale context in protein folding: villin headpiece. Biochemistry. 42: 664-71. PMID 12534278 DOI: 10.1021/Bi026510I |
0.689 |
|
| 2003 |
Dudowicz J, Freed KF, Douglas JF. Lattice model of equilibrium polymerization. IV. Influence of activation, chemical initiation, chain scission and fusion, and chain stiffness on polymerization and phase separation Journal of Chemical Physics. 119: 12645-12666. DOI: 10.1063/1.1625642 |
0.355 |
|
| 2003 |
Freed KF. Influence of monomer molecular structure on the glass transition in polymers I. Lattice cluster theory for the configurational entropy Journal of Chemical Physics. 119: 5730-5739. DOI: 10.1063/1.1600716 |
0.375 |
|
| 2003 |
Chaudhuri RK, Freed KF. A critical analysis of the ground and excited electronic states of transition metal nitrides using the relativistic effective Hamiltonian method Journal of Chemical Physics. 119: 5995-6002. DOI: 10.1063/1.1600432 |
0.329 |
|
| 2003 |
Shen MY, Freed KF. Long time dynamics of Met-enkephalin: Tests of mode-coupling theory and implicit solvent models Journal of Chemical Physics. 118: 5143-5156. DOI: 10.1063/1.1544554 |
0.59 |
|
| 2003 |
Dudowicz J, Freed KF, Shen MY. Hydration structure of met-enkephalin: A molecular dynamics study Journal of Chemical Physics. 118: 1989-1995. DOI: 10.1063/1.1531612 |
0.59 |
|
| 2003 |
Zaman MH, Shen MY, Berry RS, Freed KF. Computer simulation of Met-enkephalin using explicit atom and united atom potentials: Similarities, differences, and suggestions for improvement Journal of Physical Chemistry B. 107: 1685-1691. DOI: 10.1021/Jp026994S |
0.562 |
|
| 2002 |
Shen MY, Freed KF. All-atom fast protein folding simulations: the villin headpiece. Proteins. 49: 439-45. PMID 12402354 DOI: 10.1002/Prot.10230 |
0.583 |
|
| 2002 |
Shen My MY, Freed KF. Long time dynamics of Met-enkephalin: comparison of explicit and implicit solvent models. Biophysical Journal. 82: 1791-808. PMID 11916839 DOI: 10.1016/S0006-3495(02)75530-6 |
0.317 |
|
| 2002 |
Dudowicz J, Freed KF, Douglas JF. Beyond Flory-Huggins theory: new classes of blend miscibility associated with monomer structural asymmetry. Physical Review Letters. 88: 095503. PMID 11864024 DOI: 10.1103/Physrevlett.88.095503 |
0.58 |
|
| 2002 |
Buta D, Freed KF. Lattice polymers with structured monomers: A Monte Carlo study of thermodynamic properties of melts and solutions Journal of Chemical Physics. 116: 10959-10966. DOI: 10.1063/1.1478766 |
0.804 |
|
| 2002 |
Freed KF. Liquid-state theory derivation of surface accessible solvation potential models for proteins Journal of Chemical Physics. 116: 10475-10477. DOI: 10.1063/1.1477453 |
0.373 |
|
| 2002 |
Dudowicz J, Freed KF, Douglas JF. New patterns of polymer blend miscibility associated with monomer shape and size asymmetry Journal of Chemical Physics. 116: 9983-9996. DOI: 10.1063/1.1476696 |
0.379 |
|
| 2002 |
Frielinghaus H, Schwahn D, Willner L, Freed KF. Small angle neutron scattering studies of a polybutadiene/polystyrene blend with small additions of ortho-dichloro-benzene for varying temperatures and pressures. II. Phase boundaries and Flory-Huggins parameter Journal of Chemical Physics. 116: 2241-2250. DOI: 10.1063/1.1429960 |
0.338 |
|
| 2001 |
Niranjan PS, Forbes JG, Greer SC, Dudowicz J, Freed KF, Douglas JF. Thermodynamic regulation of actin polymerization Journal of Chemical Physics. 114: 10573-10576. DOI: 10.1063/1.1380693 |
0.314 |
|
| 2001 |
Frielinghaus H, Schwahn D, Dudowicz J, Freed KF, Foreman KW. Small-angle neutron scattering studies of polybutadiene/polystyrene blends as a function of pressure and microstructure: Comparison of experiment and theory Journal of Chemical Physics. 114: 5016-5025. DOI: 10.1063/1.1350443 |
0.33 |
|
| 2001 |
Lee S, Sun H, Kim B, Freed KF. Quantum interference and asymptotic interactions in the photodissociation of SH: Total cross section and branching ratios Journal of Chemical Physics. 114: 5537-5544. DOI: 10.1063/1.1349548 |
0.313 |
|
| 2001 |
Potts DM, Taylor CM, Chaudhuri RK, Freed KF. Improved virtual orbital-complete active space configuration interaction method, a `packageable' efficient ab initio many-body method for describing electronically excited states Journal of Chemical Physics. 114: 2592-2600. DOI: 10.1063/1.1337053 |
0.324 |
|
| 2001 |
Buta D, Freed KF, Szleifer I. Monte Carlo test of the lattice cluster theory: Thermodynamic properties of binary polymer blends Journal of Chemical Physics. 114: 1424-1431. DOI: 10.1063/1.1333024 |
0.804 |
|
| 2001 |
Chaudhuri RK, Freed KF, Abrash SA, Potts DM. A critical comparison of theoretical and experimental electronic spectrum and potential energy curves of HF molecule and its positive and negative ions Journal of Molecular Structure: Theochem. 547: 83-96. DOI: 10.1016/S0166-1280(01)00461-4 |
0.341 |
|
| 2000 |
Chaudhuri RK, Majumder S, Freed KF. Determination of conformational energy differences of propynlidyne isomers using the effective valence shell Hamiltonian method Journal of Chemical Physics. 112: 9301-9309. DOI: 10.1063/1.481551 |
0.348 |
|
| 2000 |
Seok C, Freed KF, Szleifer I. Polymer blends near patterned surfaces Journal of Chemical Physics. 112: 6452-6460. DOI: 10.1063/1.481276 |
0.303 |
|
| 2000 |
Seok C, Freed KF, Szleifer I. Polymer melts and polymer solutions near patterned surfaces Journal of Chemical Physics. 112: 6443-6451. DOI: 10.1063/1.481206 |
0.321 |
|
| 2000 |
Buta D, Freed KF, Szleifer I. Thermodynamic properties of lattice polymers: Monte Carlo simulations and mean-field theories Journal of Chemical Physics. 112: 6040-6048. DOI: 10.1063/1.481177 |
0.802 |
|
| 2000 |
Dudowicz J, Freed KF, Douglas JF. Lattice model of living polymerization. II. Interplay between polymerization and phase stability Journal of Chemical Physics. 112: 1002-1010. DOI: 10.1063/1.480624 |
0.35 |
|
| 2000 |
Dudowicz J, Freed KF. Lattice cluster theory for pedestrian. 2. Random copolymer systems Macromolecules. 33: 3467-3477. DOI: 10.1021/Ma991747G |
0.349 |
|
| 2000 |
Dudowicz J, Freed KF. Explanation for the inversion of an UCST phase diagram to a LCST diagram in binary polybutadiene blends Macromolecules. 33: 9777-9781. DOI: 10.1021/Ma001363M |
0.356 |
|
| 2000 |
Dudowicz J, Freed KF. Explanation for the unusual phase behavior of polystyrene-b-poly(n-alkyl methacrylate) diblock copolymers: specific interactions Macromolecules. 33: 5292-5299. DOI: 10.1021/Ma000232I |
0.356 |
|
| 2000 |
He Z, Martin CH, Birge R, Freed KF. Theoretical studies on excited states of a phenolate anion in the environment of photoactive yellow protein Journal of Physical Chemistry A. 104: 2939-2952. DOI: 10.1021/Jp992615S |
0.333 |
|
| 2000 |
Freed KF, Dudowicz J. Lattice cluster theory for pedestrians: Models for random copolymer blends Macromolecular Symposia. 149: 11-16. DOI: 10.1002/1521-3900(200001)149:1<11::Aid-Masy11>3.0.Co;2-N |
0.304 |
|
| 1999 |
Kostov KS, Freed KF. Long-time dynamics of Met-enkephalin: comparison of theory with Brownian dynamics simulations. Biophysical Journal. 76: 149-63. PMID 9876130 DOI: 10.1016/S0006-3495(99)77185-7 |
0.361 |
|
| 1999 |
Dudowicz J, Freed KF, Douglas JF. Lattice model of living polymerization. I. Basic thermodynamic properties Journal of Chemical Physics. 111: 7116-7130. DOI: 10.1063/1.480004 |
0.382 |
|
| 1999 |
Freed KF, Dudowicz J. Pragmatic analysis for the range of validity of the lattice cluster theory The Journal of Chemical Physics. 110: 1307-1312. DOI: 10.1063/1.478183 |
0.336 |
|
| 1999 |
Delfolie C, Dickinson LC, Freed KF, Dudowicz J, MacKnight WJ. Molecular factors affecting the miscibility behavior of cycloolefin copolymers Macromolecules. 32: 7781-7789. DOI: 10.1021/Ma990580O |
0.356 |
|
| 1998 |
Dudowicz J, Freed KF. Molecular Influences on Miscibility Patterns in Random Copolymer/Homopolymer Binary Blends. Macromolecules. 31: 5094-104. PMID 9680450 DOI: 10.1021/Ma971330F |
0.349 |
|
| 1998 |
Chaudhuri RK, Stevens JE, Freed KF. Evaluation of analytic molecular orbital derivatives and gradients using the effective valence shell Hamiltonian method Journal of Chemical Physics. 109: 9685-9693. DOI: 10.1063/1.477638 |
0.333 |
|
| 1998 |
Kostov KS, Freed KF, Webb EB, Mondello M, Grest GS. Dynamics of linear and branched alkane melts: Molecular dynamics test of theory for long time dynamics Journal of Chemical Physics. 108: 9155-9167. DOI: 10.1063/1.476414 |
0.393 |
|
| 1998 |
Tang WH, Kostov KS, Freed KF. Theory for the nonequilibrium dynamics of flexible chain molecules: Relaxation to equilibrium of pentadecane from an all-trans conformation Journal of Chemical Physics. 108: 8736-8742. DOI: 10.1063/1.476302 |
0.384 |
|
| 1998 |
Freed KF, Dudowicz J, Foreman KW. Molecular mechanisms for disparate miscibilities of poly(propylene) and head-to-head poly(propylene) with other polyolefins Journal of Chemical Physics. 108: 7881-7886. DOI: 10.1063/1.476225 |
0.359 |
|
| 1998 |
Kostov KS, Freed KF. Mode coupling theory for calculating the memory functions of flexible polymers: Local dynamics of oligoglycines The Journal of Chemical Physics. 108: 8277-8278. DOI: 10.1063/1.476182 |
0.329 |
|
| 1998 |
Chaudhuri RK, Das BP, Freed KF. Application of the effective valence shell Hamiltonian method to accurate estimation of oscillator strengths and excitation energies of Mg-like ions Journal of Chemical Physics. 108: 2556-2562. DOI: 10.1063/1.475639 |
0.321 |
|
| 1998 |
Freed KF, Dudowicz J. Lattice cluster theory for pedestrians: The incompressible limit and the miscibility of polyolefin blends Macromolecules. 31: 6681-6690. DOI: 10.1021/Ma980702X |
0.397 |
|
| 1998 |
Foreman KW, Freed KF. Lattice cluster theory of multicomponent polymer systems: Chain semiflexibility and specific interactions Advances in Chemical Physics. 103: 335-390. DOI: 10.1002/9780470141625.Ch5 |
0.342 |
|
| 1997 |
Grinberg H, Freed KF, Williams CJ. Three-dimensional infinite order sudden quantum theory for indirect photodissociation processes. Application to the photofragment yield spectrum of NOCI in the region of the T1(13A″) ←S0(11A′) transition. Fragment rotational distributions and thermal averages Journal of Chemical Physics. 107: 1849-1860. DOI: 10.1063/1.475124 |
0.356 |
|
| 1997 |
Chaudhuri RK, Freed KF. Comparison of high order perturbative convergence of multireference perturbation methods: Application to singlet states of CH2 Journal of Chemical Physics. 107: 6699-6711. DOI: 10.1063/1.474913 |
0.323 |
|
| 1997 |
Foreman KW, Freed KF, Ngola IM. Nonrandom mixing in polymer blends: Implications for phase behavior Journal of Chemical Physics. 107: 4688-4704. DOI: 10.1063/1.474830 |
0.387 |
|
| 1997 |
Grinberg H, Freed KF, Williams CJ. Three-dimensional analytical infinite order sudden quantum theory for triatomic indirect photodissociation processes Journal of Chemical Physics. 107: 1835-1848. DOI: 10.1063/1.474535 |
0.355 |
|
| 1997 |
Chaudhuri RK, Mudholkar A, Freed KF, Martin CH, Sun H. Application of the effective valence shell Hamiltonian method to accurate estimation of valence and Rydberg states oscillator strengths and excitation energies for π electron systems Journal of Chemical Physics. 106: 9252-9264. DOI: 10.1063/1.474026 |
0.314 |
|
| 1997 |
Foreman KW, Freed KF. Microscopic parameters influencing the phase separation in compressible binary blends of linear semiflexible polymers Journal of Chemical Physics. 106: 7422-7437. DOI: 10.1063/1.473702 |
0.363 |
|
| 1997 |
Chaudhuri RK, Finley JP, Freed KF. Comparison of the perturbative convergence with multireference Möller-Plesset, Epstein-Nesbet, forced degenerate and optimized zeroth order partitionings: The excited BeH2 surface Journal of Chemical Physics. 106: 4067-4081. DOI: 10.1063/1.473188 |
0.344 |
|
| 1997 |
Kostov KS, Freed KF. Mode coupling theory for calculating the memory functions of flexible chain molecules: Influence on the long time dynamics of oligoglycines Journal of Chemical Physics. 106: 771-783. DOI: 10.1063/1.3485007 |
0.377 |
|
| 1997 |
Foreman KW, Freed KF. Influence of stiffness, monomer structure, and energetic asymmetries on polymer blend miscibilities: Applications to polyolefins Macromolecules. 30: 7279-7295. DOI: 10.1021/Ma970337U |
0.376 |
|
| 1997 |
Douglas JF, Freed KF. Modification of continuum chain model of surface-interacting polymers to describe the crossover between weak and strong adsorption Macromolecules. 30: 1813-1817. DOI: 10.1021/Ma961007X |
0.368 |
|
| 1996 |
Freed KF. Analytic theory of surface segregation in compressible polymer blends Journal of Chemical Physics. 105: 10572-10582. DOI: 10.1063/1.472944 |
0.361 |
|
| 1996 |
Stevens JE, Chaudhuri RK, Freed KF. Global three-dimensional potential energy surfaces of H2S from the ab initio effective valence shell Hamiltonian method Journal of Chemical Physics. 105: 8754-8768. DOI: 10.1063/1.472735 |
0.338 |
|
| 1996 |
Guenza M, Freed KF. Extended rotational isomeric model for describing the long time dynamics of polymers Journal of Chemical Physics. 105: 3823-3837. DOI: 10.1063/1.472203 |
0.704 |
|
| 1996 |
Lifschitz M, Freed KF. Interfacial behavior of phase separated asymmetric compressible binary polymer blends Journal of Chemical Physics. 105: 1633-1645. DOI: 10.1063/1.472022 |
0.366 |
|
| 1996 |
Martin CH, Freed KF. Abinitio computation of semiempirical π‐electron methods. V. Geometry dependence of Hν π‐electron effective integrals Journal of Chemical Physics. 105: 1437-1450. DOI: 10.1063/1.472006 |
0.335 |
|
| 1996 |
Brazhnik OD, Freed KF. Application of graph theory to the statistical thermodynamics of lattice polymers. I. Elements of theory and test for dimers Journal of Chemical Physics. 105: 837-861. DOI: 10.1063/1.471892 |
0.37 |
|
| 1996 |
Cherayil BJ, Freed KF. The concentration dependent cooperative friction coefficient of dilute polymer solutions at the theta point Journal of Chemical Physics. 104: 5983-5996. DOI: 10.1063/1.471330 |
0.652 |
|
| 1996 |
Cherayil BJ, Freed KF. The concentration dependent cooperative friction coefficient of dilute polymer solutions at the theta point The Journal of Chemical Physics. 104: 5983-5996. DOI: 10.1063/1.471330 |
0.57 |
|
| 1996 |
Lee SY, Freed KF. Ab initio study of cis-butadiene valence and Rydberg states using the effective valence shell Hamiltonian method Journal of Chemical Physics. 104: 3260-3275. DOI: 10.1063/1.471091 |
0.341 |
|
| 1996 |
Chang XY, Freed KF. Theory for long time polymer and protein dynamics: Tests for all-atom models of alkane dynamics Journal of Chemical Physics. 104: 3092-3110. DOI: 10.1063/1.471075 |
0.391 |
|
| 1996 |
Dudowicz J, Freed KF. Influence of monomer structure and interaction asymmetries on the miscibility and interfacial properties of polyolefin blends Macromolecules. 29: 8960-8972. DOI: 10.1021/Ma961205O |
0.355 |
|
| 1996 |
Dudowicz J, Freed KF. Molecular origin of the free energy dependence on the monomer sequence in random copolymer systems Macromolecules. 29: 7826-7827. DOI: 10.1021/Ma960587V |
0.327 |
|
| 1996 |
Freed KF, Dudowicz J. Influence of short chain branching on the miscibility of binary polymer blends: Application to polyolefin mixtures Macromolecules. 29: 625-636. DOI: 10.1021/Ma951062Q |
0.353 |
|
| 1996 |
Freed KF, Dudowicz J. Molecular modeling of phase behavior of polymer blends Macromolecular Symposia. 112: 17-24. DOI: 10.1002/Masy.19961120104 |
0.343 |
|
| 1995 |
Freed KF, Dudowicz J. Molecular modeling of polymer blends: Stabilization of blends by block copolymers Pure and Applied Chemistry. 67: 969-976. DOI: 10.1351/Pac199567060969 |
0.383 |
|
| 1995 |
Finley JP, Chaudhuri RK, Freed KF. Applications of multireference perturbation theory to potential energy surfaces by optimal partitioning of H: Intruder states avoidance and convergence enhancement The Journal of Chemical Physics. 103: 4990-5010. DOI: 10.1063/1.470586 |
0.349 |
|
| 1995 |
Li W, Freed KF. Lattice cluster theory for phase behavior of rectangular mesogens. II. Nearest‐neighbor interactions, phase diagrams, and competitive nematic orderings The Journal of Chemical Physics. 103: 5693-5711. DOI: 10.1063/1.470552 |
0.33 |
|
| 1995 |
Freed KF. Interrelation between density functional and self-consistent-field formulations for inhomogeneous polymer systems The Journal of Chemical Physics. 103: 3230-3239. DOI: 10.1063/1.470255 |
0.329 |
|
| 1995 |
Lifschitz M, Freed KF, Tang H. Hyperbolic tangent variational approximation for interfacial profiles of binary polymer blends The Journal of Chemical Physics. 103: 3767-3781. DOI: 10.1063/1.470056 |
0.366 |
|
| 1995 |
Hu Y, Kostov K, Perico A, Smithline S, Freed KF. Extended molecular dynamics and optimized Rouse-Zimm model studies of a short peptide: Various friction approximations The Journal of Chemical Physics. 103: 9091-9100. DOI: 10.1063/1.470020 |
0.656 |
|
| 1995 |
Tang WH, Chang XY, Freed KF. Theory for long time polymer and protein dynamics: Basis functions and time correlation functions The Journal of Chemical Physics. 103: 9492-9501. DOI: 10.1063/1.470010 |
0.386 |
|
| 1995 |
Pratolongo R, Perico A, Freed KF, Szabo A. Multiexponential approximations to the torsional time correlation function for one‐dimensional systems with many barriers The Journal of Chemical Physics. 102: 4683-4690. DOI: 10.1063/1.469516 |
0.668 |
|
| 1995 |
Foreman KW, Freed KF. Generalizations of Huggins-Guggenheim-Miller-type theories to describe the architecture of branched lattice chains The Journal of Chemical Physics. 102: 4663-4672. DOI: 10.1063/1.469514 |
0.369 |
|
| 1995 |
Finley JP, Freed KF. Application of complete space multireference many-body perturbation theory to N2: Dependence on reference space and H0 The Journal of Chemical Physics. 102: 1306-1333. DOI: 10.1063/1.468919 |
0.341 |
|
| 1995 |
Dudowicz J, Freed KF. Pressure Dependence of Polymer Fluids: Application of the Lattice Cluster Theory Macromolecules. 28: 6625-6641. DOI: 10.1021/Ma00123A033 |
0.37 |
|
| 1995 |
Dudowicz J, Freed KF, Douglas JF. Modification of the Phase Stability of Polymer Blends by Diblock Copolymer Additives Macromolecules. 28: 2276-2287. DOI: 10.1021/Ma00111A023 |
0.324 |
|
| 1994 |
Li W, Freed KF. Lattice cluster theory for phase behavior of rectangular mesogens The Journal of Chemical Physics. 101: 519-532. DOI: 10.1063/1.468162 |
0.303 |
|
| 1994 |
Nemirovsky AM, Huston SE, Graham RL, Freed KF. Packing rods on d‐dimensional lattices: From direct enumeration to series expansions The Journal of Chemical Physics. 101: 510-518. DOI: 10.1063/1.468161 |
0.336 |
|
| 1994 |
Brazhnik PK, Freed KF, Tang H. Polymer melt near a solid wall The Journal of Chemical Physics. 101: 9143-9154. DOI: 10.1063/1.468044 |
0.361 |
|
| 1994 |
Perico A, Pratolongo R, Freed KF, Szabo A. Torsional time correlation function for one‐dimensional systems with barrier crossing: Periodic potential The Journal of Chemical Physics. 101: 2554-2561. DOI: 10.1063/1.467628 |
0.622 |
|
| 1994 |
Martin CH, Freed KF. Ab initio computation of semiempirical π‐electron methods. II. Transferability of Hν parameters between ethylene, trans‐butadiene, and cyclobutadiene The Journal of Chemical Physics. 101: 4011-4027. DOI: 10.1063/1.467519 |
0.305 |
|
| 1994 |
Stevens JE, Freed KF, Arendt MF, Graham RL. Excited potential energy surfaces of CH3SH from the ab initio effective valence shell Hamiltonian method The Journal of Chemical Physics. 101: 4832-4841. DOI: 10.1063/1.467406 |
0.321 |
|
| 1994 |
Martin CH, Freed KF. Abinitiocomputation of semiempirical π‐electron methods. III. The benzene molecule, the zero‐differential‐overlap approximation, and the transferability of parameters The Journal of Chemical Physics. 101: 5929-5941. DOI: 10.1063/1.467310 |
0.339 |
|
| 1994 |
Grinberg H, Williams CJ, Freed KF. Three‐dimensional analytical infinite order sudden quantum theory for triatomic photodissociation: Dependence on initial rotational and vibrational state and on thermal averages for NOCl dissociation onT1(1 3A‘) surface The Journal of Chemical Physics. 100: 9215-9227. DOI: 10.1063/1.467257 |
0.339 |
|
| 1994 |
Hurtubise V, Freed KF. Perturbative and complete model space linked diagrammatic expansions for the canonical effective operator The Journal of Chemical Physics. 100: 4955-4968. DOI: 10.1063/1.467215 |
0.314 |
|
| 1994 |
Martin CH, Freed KF. Ab initio computation of semiempirical π‐electron methods. I. Constrained, transferable valence spaces in Hν calculations The Journal of Chemical Physics. 100: 7454-7470. DOI: 10.1063/1.466889 |
0.349 |
|
| 1994 |
Lifschitz M, Dudowicz J, Freed KF. Limits of validity for mean field description of compressible binary polymer blends The Journal of Chemical Physics. 100: 3957-3978. DOI: 10.1063/1.466330 |
0.349 |
|
| 1994 |
Dudowicz J, Freed KF. Lattice cluster theory of compressible diblock copolymer melts The Journal of Chemical Physics. 100: 4653-4664. DOI: 10.1063/1.466248 |
0.381 |
|
| 1994 |
Douglas JF, Freed KF. Competition between Hydrodynamic Screening ("Draining") and Excluded Volume Interactions in an Isolated Polymer Chain Macromolecules. 27: 6088-6099. DOI: 10.1021/Ma00099A022 |
0.363 |
|
| 1994 |
Dudowicz J, Freed KF, Lifschitz M. Toward a Molecular Basis for Understanding the Behavior of Isotopic Polymer Blends: Lattice Cluster Theory Computations for PSD/PSH Blends Macromolecules. 27: 5387-5398. DOI: 10.1021/Ma00097A020 |
0.368 |
|
| 1994 |
Martin CH, Graham RL, Freed KF. Ab Initio Vertical Ionization Potentials of trans-Butadiene and Cyclobutadiene Using the Effective Valence Shell Hamiltonian Method The Journal of Physical Chemistry. 98: 3467-3471. DOI: 10.1021/J100064A031 |
0.303 |
|
| 1994 |
Chang X, Freed KF. Towards a molecular theory for modeling long-time polymer dynamics Chemical Engineering Science. 49: 2821-2832. DOI: 10.1016/0009-2509(94)E0101-U |
0.371 |
|
| 1994 |
Freed KF, Dudowicz J. Towards a molecular theory of polymer blends Macromolecular Symposia. 78: 29-40. DOI: 10.1002/Masy.19940780105 |
0.373 |
|
| 1993 |
Huston SE, Nemirovsky AM, Freed KF. Lattice cluster theory for the packing of rods on a lattice: Extension to treat anisotropic orientational distributions The Journal of Chemical Physics. 99: 2149-2166. DOI: 10.1063/1.466178 |
0.35 |
|
| 1993 |
Dudowicz J, Lifschitz M, Freed KF, Douglas JF. How far is far from critical point in polymer blends? Lattice cluster theory computations for structured monomer, compressible systems The Journal of Chemical Physics. 99: 4804-4820. DOI: 10.1063/1.466028 |
0.378 |
|
| 1993 |
Chang X, Freed KF. Test of theory for long time dynamics of floppy molecules in solution using Brownian dynamics simulation of octane The Journal of Chemical Physics. 99: 8016-8030. DOI: 10.1063/1.465679 |
0.331 |
|
| 1993 |
Martin CH, Graham RL, Freed KF. Abinitiostudy of cyclobutadiene using the effective valence shell Hamiltonian method The Journal of Chemical Physics. 99: 7833-7844. DOI: 10.1063/1.465662 |
0.327 |
|
| 1993 |
Hose G, Freed KF. Photodissociation of molecules physisorbed on inert crystalline surfaces The Journal of Chemical Physics. 98: 7527-7551. DOI: 10.1063/1.464694 |
0.31 |
|
| 1993 |
Perico A, Pratolongo R, Freed KF, Pastor RW, Szabo A. Positional time correlation function for one‐dimensional systems with barrier crossing: Memory function corrections to the optimized Rouse–Zimm approximation The Journal of Chemical Physics. 98: 564-573. DOI: 10.1063/1.464598 |
0.64 |
|
| 1993 |
Li W, Freed KF, Nemirovsky AM. Packing entropy of extended, hard, rigid objects on a lattice The Journal of Chemical Physics. 98: 8469-8483. DOI: 10.1063/1.464506 |
0.331 |
|
| 1993 |
Lifschitz M, Freed KF. Interfacial behavior of compressible polymer blends The Journal of Chemical Physics. 98: 8994-9013. DOI: 10.1063/1.464459 |
0.351 |
|
| 1993 |
Myers KR, Freed KF. Surface tension of dilute polymer solutions. II. The second virial coefficient The Journal of Chemical Physics. 98: 2437-2450. DOI: 10.1063/1.464171 |
0.346 |
|
| 1993 |
Merkle G, Burchard W, Freed KF, Gao J. Osmotic pressure of linear, star, and ring polymers in semidilute solution. A comparison between experiment and theory Macromolecules. 26: 2736-2742. DOI: 10.1021/Ma00063A016 |
0.353 |
|
| 1993 |
Dudowicz J, Freed KF. Relation of effective interaction parameters for binary blends and diblock copolymers: lattice cluster theory predictions and comparisons with experiment Macromolecules. 26: 213-220. DOI: 10.1021/Ma00053A033 |
0.345 |
|
| 1993 |
Kostov K, Freed KF, Perico A. Effect of various frictional models on long-time peptide dynamics Biopolymers. 33: 1423-1429. DOI: 10.1002/Bip.360330912 |
0.661 |
|
| 1992 |
Nemirovsky AM, Dudowicz J, Freed KF. Dense self-interacting lattice trees with specified topologies: From light to dense branching. Physical Review. A. 45: 7111-7127. PMID 9906784 DOI: 10.1103/Physreva.45.7111 |
0.335 |
|
| 1992 |
Tang H, Freed KF. Surface properties of semi‐infinite diblock copolymer melts The Journal of Chemical Physics. 97: 4496-4504. DOI: 10.1063/1.463893 |
0.338 |
|
| 1992 |
Freed KF, Dudowicz J. On the large entropic contribution to the effective interaction parameter of polystyrene–poly(methyl methacrylate) diblock copolymer systems The Journal of Chemical Physics. 97: 2105-2109. DOI: 10.1063/1.463149 |
0.338 |
|
| 1992 |
Myers KR, Nemirovsky AM, Freed KF. Surface tension of dilute polymer solutions. I. A renormalization group approach The Journal of Chemical Physics. 97: 2790-2803. DOI: 10.1063/1.463071 |
0.327 |
|
| 1992 |
Zeng XC, Oxtoby DW, Tang H, Freed KF. On square-gradient theories of polymer blend interfaces The Journal of Chemical Physics. 96: 4816-4817. DOI: 10.1063/1.462771 |
0.602 |
|
| 1992 |
Tang H, Freed KF. Immiscibility induced chain stretching, local segregation, and formation of locally ordered domains in diblock copolymers The Journal of Chemical Physics. 96: 8621-8623. DOI: 10.1063/1.462266 |
0.317 |
|
| 1992 |
Dudowicz J, Freed KF. Influence of compressibility and monomer structure on small angle neutron scattering from binary polymer blends The Journal of Chemical Physics. 96: 9147-9156. DOI: 10.1063/1.462225 |
0.379 |
|
| 1992 |
Graham RL, Freed KF. Ab initio study of the trans‐butadiene π‐valence states using the effective valence shell Hamiltonian method The Journal of Chemical Physics. 96: 1304-1316. DOI: 10.1063/1.462166 |
0.332 |
|
| 1992 |
Dudowicz J, Freed KF. Correlation lengths and chain sizes in PS/PVME blends: Influence of compressibility, interactions, and monomer structures The Journal of Chemical Physics. 96: 1644-1647. DOI: 10.1063/1.462150 |
0.357 |
|
| 1992 |
Freed KF, Dudowicz J. Role of monomer structure and compressibility on the properties of multicomponent polymer blends and solutions Theoretica Chimica Acta. 82: 357-382. DOI: 10.1007/Bf01113938 |
0.396 |
|
| 1992 |
Nemirovsky AM, Dudowicz J, Freed KF. Thermodynamics of a dense self-avoiding walk with contact interactions Journal of Statistical Physics. 67: 395-412. DOI: 10.1007/Bf01049041 |
0.364 |
|
| 1992 |
Nemirovsky AM, Freed KF, Ishinabe T, Douglas JF. Marriage of exact enumeration and 1/d expansion methods: Lattice model of dilute polymers Journal of Statistical Physics. 67: 1083-1108. DOI: 10.1007/Bf01049010 |
0.36 |
|
| 1991 |
Myers K, Nemirovsky AM, Freed KF, Wang Z. Conformations of a polymer boxed into a corner: Role of excluded volume The Journal of Chemical Physics. 95: 6112-6123. DOI: 10.1063/1.461580 |
0.34 |
|
| 1991 |
Tang H, Freed KF. Chain stretching in ordered microphases of diblock copolymers The Journal of Chemical Physics. 95: 3012-3013. DOI: 10.1063/1.460904 |
0.325 |
|
| 1991 |
Tang H, Freed KF. Interfacial studies of incompressible binary blends The Journal of Chemical Physics. 94: 6307-6322. DOI: 10.1063/1.460419 |
0.329 |
|
| 1991 |
Tang H, Freed KF. Free energy functional expansion for inhomogeneous polymer blends The Journal of Chemical Physics. 94: 1572-1583. DOI: 10.1063/1.459962 |
0.359 |
|
| 1991 |
Kanzler AW, Freed KF. Effective valence shell Hamiltonian and potential curves of the oxygen molecule from quasidegenerate many‐body perturbation theory The Journal of Chemical Physics. 94: 3778-3789. DOI: 10.1063/1.459750 |
0.353 |
|
| 1991 |
Dudowicz J, Freed KF. Effect of monomer structure and compressibility on the properties of multicomponent polymer blends and solutions. 3. Application to deuterated polystyrene [PS(D)]poly(vinyl methyl ether) (PVME) blends Macromolecules. 24: 5112-5123. DOI: 10.1021/Ma00018A016 |
0.308 |
|
| 1991 |
Dudowicz J, Freed MS, Freed KF. Effect of monomer structure and compressibility on the properties of multicomponent polymer blends and solutions. 2. Application to binary blends Macromolecules. 24: 5096-5111. DOI: 10.1021/Ma00018A015 |
0.318 |
|
| 1991 |
Dudowicz J, Freed KF. Effect of monomer structure and compressibility on the properties of multicomponent polymer blends and solutions: 1. Lattice cluster theory of compressible systems Macromolecules. 24: 5076-5095. DOI: 10.1021/Ma00018A014 |
0.34 |
|
| 1991 |
Tang H, Freed KF. Static structure factors of compressible polymer blends and diblock copolymer melts. 2. Constraints on density fluctuations Macromolecules. 24: 958-966. DOI: 10.1021/Ma00004A024 |
0.319 |
|
| 1991 |
Hu Y, Fleming GR, Freed KF, Perico A. Theory of long time peptide dynamics: Test of various reduced descriptions and role of internal variables Chemical Physics. 158: 395-408. DOI: 10.1016/0301-0104(91)87079-B |
0.67 |
|
| 1991 |
Grinberg H, Freed KF, Williams CJ. Influence of initial state bend—stretch couplings on product rotational distributions in photodissociation of bent triatomic molecules Chemical Physics Letters. 182: 297-303. DOI: 10.1016/0009-2614(91)80218-M |
0.324 |
|
| 1990 |
Hu Y, MacInnis JM, Cherayil BJ, Fleming GR, Freed KF, Perico A. Polypeptide dynamics: Experimental tests of an optimized Rouse–Zimm type model The Journal of Chemical Physics. 93: 822-836. DOI: 10.1063/1.459452 |
0.748 |
|
| 1990 |
McMullen WE, Freed KF. A density functional theory of polymer phase transitions and interfaces. II. Block copolymers The Journal of Chemical Physics. 93: 9130-9144. DOI: 10.1063/1.459203 |
0.365 |
|
| 1990 |
Gao J, Freed KF, Rice SA. Light scattering with evanescent waves: Intermolecular interference and the structure factor for an ideal flexible chain at an interacting interface The Journal of Chemical Physics. 93: 2785-2800. DOI: 10.1063/1.458864 |
0.464 |
|
| 1990 |
Grinberg H, Freed KF, Williams CJ. Three‐dimensional analytic quantum theory for triatomic photodissociations. II. Angle dependent dissociative surfaces and rotational infinite order sudden approximation for bent triatomics The Journal of Chemical Physics. 92: 7283-7301. DOI: 10.1063/1.458214 |
0.322 |
|
| 1990 |
McMullen WE, Freed KF. A density functional theory of polymer phase transitions and interfaces The Journal of Chemical Physics. 92: 1413-1426. DOI: 10.1063/1.458153 |
0.367 |
|
| 1990 |
Dudowicz J, Freed KF, Madden WG. Role of molecular structure on the thermodynamic properties of melts, blends, and concentrated polymer solutions: comparison of Monte Carlo simulations with the cluster theory for the lattice model Macromolecules. 23: 4803-4819. DOI: 10.1021/Ma00224A009 |
0.39 |
|
| 1990 |
Douglas JF, Roovers J, Freed KF. Characterization of branching architecture through "universal" ratios of polymer solution properties Macromolecules. 23: 4168-4180. DOI: 10.1021/Ma00220A022 |
0.347 |
|
| 1990 |
Dudowicz J, Freed KF. Influence of blend compressibility on extrapolated zero-angle coherent scattering and spinodal: limitations of RPA [random-phase approximation] analysis Macromolecules. 23: 1519-1526. DOI: 10.1021/Ma00207A047 |
0.35 |
|
| 1990 |
Madden WG, Pesci AI, Freed KF. Phase equilibria of lattice polymer and solvent: tests of theories against simulations Macromolecules. 23: 1181-1191. DOI: 10.1021/Ma00206A042 |
0.377 |
|
| 1990 |
McMullen WE, Freed KF. The static structure factors of compressible polymer blends and diblock copolymer melts Macromolecules. 23: 255-262. DOI: 10.1021/Ma00203A044 |
0.325 |
|
| 1990 |
Lee S, Williams CJ, Freed KF. Theory of Diatomic Photodissociation to Atomic Hyperfine Structure States Israel Journal of Chemistry. 30: 3-11. DOI: 10.1002/Ijch.199000002 |
0.324 |
|
| 1989 |
Perico A, La Ferla R, Freed KF. Leading concentration correction to polymer dynamic self‐structure factor The Journal of Chemical Physics. 91: 4387-4400. DOI: 10.1063/1.457636 |
0.666 |
|
| 1989 |
Singer SJ, Lee S, Freed KF. Incorporating advantages of time-dependent dynamics in time-independent collision methods: Early asymptotic analysis The Journal of Chemical Physics. 91: 240-249. DOI: 10.1063/1.457511 |
0.546 |
|
| 1989 |
Wang X, Freed KF. Ab initio test of the pairwise additivity assumption of semiempirical electronic structure: Spectator model of correlation contributions The Journal of Chemical Physics. 91: 1151-1166. DOI: 10.1063/1.457188 |
0.321 |
|
| 1989 |
Wang X, Freed KF. Quasidegenerate many‐body perturbation theory of CH2 The Journal of Chemical Physics. 91: 1142-1150. DOI: 10.1063/1.457187 |
0.339 |
|
| 1989 |
Wang X, Freed KF. Comparison of complete model space quasidegenerate many‐body perturbation theory for LiH with multireference coupled cluster method The Journal of Chemical Physics. 91: 3002-3011. DOI: 10.1063/1.456921 |
0.319 |
|
| 1989 |
Pesci AI, Freed KF. Lattice theory of polymer blends and liquid mixtures: Beyond the Flory–Huggins approximation The Journal of Chemical Physics. 90: 2017-2026. DOI: 10.1063/1.456044 |
0.389 |
|
| 1989 |
Pesci AI, Freed KF. Lattice models of polymer fluids: Monomers occupying several lattice sites. II. Interaction energies The Journal of Chemical Physics. 90: 2003-2016. DOI: 10.1063/1.456043 |
0.38 |
|
| 1989 |
Freed KF. Cluster expansion for flexible polymeric fluids in which bonding constraints are treated as perturbations The Journal of Chemical Physics. 90: 3261-3267. DOI: 10.1063/1.455879 |
0.348 |
|
| 1989 |
Rabin Y, Wang SQ, Freed KF. Dilute polymer solutions in flow: derivation of hydrodynamic equations Macromolecules. 22: 2420-2426. DOI: 10.1021/Ma00195A071 |
0.59 |
|
| 1989 |
McMullen WE, Freed KF, Cherayil BJ. Apparent radius of gyration of diblock copolymers Macromolecules. 22: 1853-1862. DOI: 10.1021/Ma00194A057 |
0.569 |
|
| 1989 |
Freed KF, Bawendi MG. Lattice theories of polymeric fluids The Journal of Physical Chemistry. 93: 2194-2203. DOI: 10.1021/J100343A006 |
0.47 |
|
| 1988 |
Wang S, Freed KF. On the equivalence of the Kirkwood diffusion equation to the coupled polymer-solvent Langevin dynamics Journal of Physics a: Mathematical and General. 21: 2453-2471. DOI: 10.1088/0305-4470/21/10/022 |
0.578 |
|
| 1988 |
Freed KF. Role of free volume on the interpretation of effective blend interaction parameters from neutron scattering data The Journal of Chemical Physics. 88: 5871-5873. DOI: 10.1063/1.454519 |
0.315 |
|
| 1988 |
Cherayil BJ, Freed KF. Semidilute good solvent solutions of polymers in a box. Finite size corrections by renormalization group methods The Journal of Chemical Physics. 88: 7851-7861. DOI: 10.1063/1.454299 |
0.649 |
|
| 1988 |
Freed KF, Douglas JF. Comparison between Borel resummation and renormalization group descriptions of polymer expansion The Journal of Chemical Physics. 88: 2764-2768. DOI: 10.1063/1.454007 |
0.304 |
|
| 1988 |
Bawendi MG, Freed KF. Systematic corrections to Flory–Huggins theory: Polymer–solvent–void systems and binary blend–void systems The Journal of Chemical Physics. 88: 2741-2756. DOI: 10.1063/1.454005 |
0.562 |
|
| 1988 |
Sun H, Freed KF. Molecular properties byabinitioquasidegenerate many‐body perturbation theory effective Hamiltonian method: Dipole and transition moments of CH and CH+ The Journal of Chemical Physics. 88: 2659-2665. DOI: 10.1063/1.453993 |
0.341 |
|
| 1988 |
Wang S, Freed KF. Langevin dynamics of Rouse chains under flow The Journal of Chemical Physics. 88: 3944-3954. DOI: 10.1063/1.453843 |
0.629 |
|
| 1988 |
Cherayil BJ, Freed KF. The Flory .chi. parameter and phase separation in semidilute polymer mixtures: a renormalization group study Macromolecules. 21: 3204-3216. DOI: 10.1021/Ma00189A014 |
0.595 |
|
| 1988 |
Freed KF, Wang SQ, Roovers J, Douglas JF. Partial draining and universality of dilute solution polymer dynamics: comparison of theory and experiment Macromolecules. 21: 2219-2224. DOI: 10.1021/Ma00185A057 |
0.641 |
|
| 1988 |
Sun H, Lee YS, Freed KF. Dipole moment functions of OH by ab initio effective valence shell hamiltonian method Chemical Physics Letters. 150: 529-534. DOI: 10.1016/0009-2614(88)87242-7 |
0.343 |
|
| 1988 |
Jhon MS, Metz RJ, Freed KF. Effective medium theory for elastic matrix composites containing dispersed particulates Journal of Statistical Physics. 52: 1325-1342. DOI: 10.1007/Bf01011650 |
0.308 |
|
| 1987 |
Williams CJ, Freed KF. Low-energy atomic scattering of ground-state C+(2P) ions by atomic hydrogen: Role of non-adiabatic couplings and resonances in elastic and inelastic processes Journal of Physics B: Atomic and Molecular Physics. 20: 5737-5752. DOI: 10.1088/0022-3700/20/21/021 |
0.307 |
|
| 1987 |
Bawendi MG, Freed KF, Mohanty U. A lattice field theory for polymer systems with nearest‐neighbor interaction energies The Journal of Chemical Physics. 87: 5534-5540. DOI: 10.1063/1.453638 |
0.538 |
|
| 1987 |
Lee S, Freed KF. Theoretical analysis of nonadiabatic effects on the predissociation of theA 2Σ+state of OH The Journal of Chemical Physics. 87: 5772-5780. DOI: 10.1063/1.453551 |
0.345 |
|
| 1987 |
Freed KF, Pesci AI. Theory of the molecular origins of the entropic portion of the Flory χ parameter for polymer blends The Journal of Chemical Physics. 87: 7342-7344. DOI: 10.1063/1.453329 |
0.374 |
|
| 1987 |
Nemirovsky AM, Bawendi MG, Freed KF. Lattice models of polymer solutions: Monomers occupying several lattice sites The Journal of Chemical Physics. 87: 7272-7284. DOI: 10.1063/1.453320 |
0.536 |
|
| 1987 |
Wang S, Douglas JF, Freed KF. Influence of variable draining and excluded volume on hydrodynamic radius within Kirkwood–Riseman model: Dynamical renormalization group description to order ε2 The Journal of Chemical Physics. 87: 1346-1354. DOI: 10.1063/1.453316 |
0.656 |
|
| 1987 |
Cherayil BJ, Douglas JF, Freed KF. Effect of residual interactions on polymer properties near the theta point. II. Higher moments and comparison with Monte Carlo calculations The Journal of Chemical Physics. 87: 3089-3098. DOI: 10.1063/1.453046 |
0.664 |
|
| 1987 |
Singer SJ, Lee S, Freed KF, Band YB. Multichannel quantum theory for propagation of second order transition amplitudes The Journal of Chemical Physics. 87: 4762-4778. DOI: 10.1063/1.452839 |
0.554 |
|
| 1987 |
Band YB, Freed KF, Singer SJ. Erratum: Orientation, alignment, and hyperfine effects on dissociation of diatomic molecules to open shell atoms [J. Chem. Phys. 84, 3762 (1986)] The Journal of Chemical Physics. 86: 1650-1650. DOI: 10.1063/1.452781 |
0.536 |
|
| 1987 |
Wang X, Freed KF. Electronic structure and bond length dependence of the effective valence shell Hamiltonian of S2 as studied by quasidegenerate many‐body perturbation theory The Journal of Chemical Physics. 86: 2899-2908. DOI: 10.1063/1.452753 |
0.357 |
|
| 1987 |
Grinberg H, Freed KF, Williams CJ. Three‐dimensional analytical quantum mechanical theory for triatomic photodissociation: Role of angle dependent dissociative surfaces on rotational and angular distributions in the rotational infinite order sudden limit The Journal of Chemical Physics. 86: 5456-5478. DOI: 10.1063/1.452570 |
0.348 |
|
| 1987 |
Perico A, La Ferla R, Freed KF. Dynamic multiple scattering theory of the Huggins coefficient for discrete Gaussian chains. II. Numerical computations of the frequency dependence and steady state limit The Journal of Chemical Physics. 86: 5842-5851. DOI: 10.1063/1.452514 |
0.674 |
|
| 1987 |
Perico A, Freed KF. Dynamic multiple scattering theory of the Huggins coefficient for discrete Gaussian chains. I. Formal derivation of the full frequency dependence The Journal of Chemical Physics. 86: 5830-5841. DOI: 10.1063/1.452513 |
0.658 |
|
| 1987 |
Cherayil BJ, Kholodenko AL, Freed KF. Semidilute polymer solutions in the theta domain: A renormalization group study The Journal of Chemical Physics. 86: 7204-7217. DOI: 10.1063/1.452322 |
0.633 |
|
| 1987 |
Rosman RL, Villaeys AA, Freed KF, Rice SA. Lifetimes of degenerate benzene 1B2u levels split by vibrational angular momentum The Journal of Chemical Physics. 86: 2576-2587. DOI: 10.1063/1.452060 |
0.465 |
|
| 1987 |
Wang S, Freed KF. Renormalization group theory of the Rouse–Zimm model of polymer dynamics to second order in ε. II. Dynamic intrinsic viscosity of Gaussian chains The Journal of Chemical Physics. 86: 3021-3031. DOI: 10.1063/1.452057 |
0.651 |
|
| 1987 |
Bawendi MG, Freed KF. A lattice model for self‐ and mutually avoiding semiflexible polymer chains The Journal of Chemical Physics. 86: 3720-3730. DOI: 10.1063/1.451974 |
0.549 |
|
| 1987 |
Douglas JF, Freed KF. Block copolymers and polymer mixtures in dilute solution: General crossover analysis and comparison with Monte Carlo calculations The Journal of Chemical Physics. 86: 4280-4293. DOI: 10.1063/1.451888 |
0.372 |
|
| 1987 |
Wang Z, Nemirovsky AM, Freed KF. Polymers with excluded volume in various geometries: Renormalization group methods The Journal of Chemical Physics. 86: 4266-4279. DOI: 10.1063/1.451887 |
0.357 |
|
| 1987 |
Cherayil BJ, Douglas JF, Freed KF. Change of a flexible polymer's free energy due to excluded volume, molecular architecture and the presence of boundaries Macromolecules. 20: 1345-1353. DOI: 10.1021/Ma00172A030 |
0.615 |
|
| 1987 |
Douglas JF, Wang SQ, Freed KF. Flexible polymers with excluded volume at a penetrable interacting surface Macromolecules. 20: 543-551. DOI: 10.1021/Ma00169A013 |
0.619 |
|
| 1987 |
Band YB, Freed KF, Singer SJ, Williams CJ. Nonadiabatic effects on the photodissociation of diatomic molecules to open-shell atoms Journal of Physical Chemistry. 91: 5402-5409. DOI: 10.1021/J100305A005 |
0.555 |
|
| 1987 |
Hoffmann MR, Wang X, Freed KF. Influence of molecular geometry on valence space for quasidegenerate many-body perturbation theory Chemical Physics Letters. 136: 392-397. DOI: 10.1016/0009-2614(87)80273-7 |
0.328 |
|
| 1986 |
Bawendi MG, Freed KF. Statistical mechanics of the packing of rods on a lattice: Cluster expansion for systematic corrections to mean field The Journal of Chemical Physics. 85: 3007-3022. DOI: 10.1063/1.451830 |
0.515 |
|
| 1986 |
Wang S, Freed KF. Renormalization group study of Rouse–Zimm model of polymer dynamics through second order in ε The Journal of Chemical Physics. 85: 6210-6224. DOI: 10.1063/1.451487 |
0.639 |
|
| 1986 |
Williams CJ, Freed KF. Dynamics and spectroscopy of near threshold nonadiabatic resonances in photodissociation to open shell atoms: CH+a model system The Journal of Chemical Physics. 85: 2699-2717. DOI: 10.1063/1.451027 |
0.332 |
|
| 1986 |
Wang Z, Nemirovsky AM, Freed KF. Interaction of a polymer chain with an asymmetric liquid–liquid interface The Journal of Chemical Physics. 85: 3068-3077. DOI: 10.1063/1.451014 |
0.362 |
|
| 1986 |
Wang S, Douglas JF, Freed KF. Corrections to preaveraging approximation within the Kirkwood–Riseman model for flexible polymers: Calculations to second order in ε with both hydrodynamic and excluded volume interactions The Journal of Chemical Physics. 85: 3674-3687. DOI: 10.1063/1.450937 |
0.666 |
|
| 1986 |
Bawendi MG, Freed KF, Mohanty U. A lattice model for self‐avoiding polymers with controlled length distributions. II. Corrections to Flory–Huggins mean field The Journal of Chemical Physics. 84: 7036-7047. DOI: 10.1063/1.450625 |
0.539 |
|
| 1986 |
Bawendi MG, Freed KF. Renormalization group treatment of excluded volume effects in a polyelectrolyte chain in the weak electrostatic coupling limit. II. Decomposition of interactions and calculation of properties The Journal of Chemical Physics. 84: 449-464. DOI: 10.1063/1.450160 |
0.535 |
|
| 1986 |
Williams CJ, Freed KF, Singer SJ, Band YB. Non-adiabatic effects on the photodissociation of diatomic molecules to open-shell atoms: Resonances, polarizations and angular distributions for the CH+ model systems Faraday Discussions of the Chemical Society. 82: 51-66. DOI: 10.1039/Dc9868200051 |
0.557 |
|
| 1986 |
Cherayil BJ, Bawendi MG, Miyake A, Freed KF. Osmotic pressure of star and ring polymers in semidilute solution Macromolecules. 19: 2770-2778. DOI: 10.1021/Ma00165A019 |
0.661 |
|
| 1986 |
Douglas JF, Wang SQ, Freed KF. Test of renormalization group crossover dependence: comparison with exact solution for a polymer attached to a penetrable interacting hypersurface Macromolecules. 19: 2207-2220. DOI: 10.1021/Ma00162A018 |
0.634 |
|
| 1986 |
Douglas JF, Nemirovsky AM, Freed KF. Polymer-polymer and polymer-surface excluded volume effects in flexible polymers attached to an interface: comparison of renormalization group calculations with Monte Carlo and direct enumeration data Macromolecules. 19: 2041-2054. DOI: 10.1021/Ma00161A043 |
0.338 |
|
| 1986 |
Nemirovsky A, Freed KF. Surface and finite size effects in critical phenomena Nuclear Physics B. 270: 423-456. DOI: 10.1016/0550-3213(86)90562-6 |
0.329 |
|
| 1986 |
Lee S, Williams CJ, Freed KF. Non-adiabatic effects on oxygen atom fine structure populations in the predissociation of the A2Σ+ state of OH Chemical Physics Letters. 130: 271-277. DOI: 10.1016/0009-2614(86)80468-7 |
0.321 |
|
| 1986 |
Williams CJ, Freed KF. Spectroscopy of low-energy non-adiabatic resonances in photodissociation to open-shell atoms: CH+, a model system Chemical Physics Letters. 127: 360-366. DOI: 10.1016/0009-2614(86)80296-2 |
0.308 |
|
| 1985 |
Freed K. Polymers and random walks - renormalization group description and comparison with experiment Journal of Research of the National Bureau of Standards. 90: 503. DOI: 10.6028/Jres.090.050 |
0.376 |
|
| 1985 |
Freed KF. New lattice model for interacting, avoiding polymers with controlled length distribution Journal of Physics a: Mathematical and General. 18: 871-877. DOI: 10.1088/0305-4470/18/5/019 |
0.367 |
|
| 1985 |
Nemirovsky AM, Freed KF. Surface transition and epsilon expansion Journal of Physics a: Mathematical and General. 18: 3275-3279. DOI: 10.1088/0305-4470/18/16/027 |
0.316 |
|
| 1985 |
Band YB, Freed KF, Singer SJ. Orientation, alignment, and hyperfine effects on dissociation of diatomic molecules to open shell atoms The Journal of Chemical Physics. 84: 3762-3770. DOI: 10.1063/1.450217 |
0.557 |
|
| 1985 |
Cherayil BJ, Douglas JF, Freed KF. Effect of residual interactions on polymer properties near the theta point The Journal of Chemical Physics. 83: 5293-5310. DOI: 10.1063/1.449692 |
0.645 |
|
| 1985 |
Bawendi MG, Freed KF. A Wiener integral model for stiff polymer chains The Journal of Chemical Physics. 83: 2491-2496. DOI: 10.1063/1.449296 |
0.512 |
|
| 1985 |
Nemirovsky AM, Freed KF. Excluded volume effects for polymers in presence of interacting surfaces: Chain conformation renormalization group The Journal of Chemical Physics. 83: 4166-4182. DOI: 10.1063/1.449082 |
0.38 |
|
| 1985 |
Wang SQ, Douglas JF, Freed KF. Influence of draining and excluded volume on the intrinsic viscosity of flexible polymers Macromolecules. 18: 2464-2474. DOI: 10.1021/Ma00154A021 |
0.594 |
|
| 1985 |
Douglas JF, Cherayil BJ, Freed KF. Polymers in two dimensions: renormalization group study using three-parameter model Macromolecules. 18: 2455-2463. DOI: 10.1021/Ma00154A020 |
0.599 |
|
| 1985 |
Cherayil BJ, Douglas JF, Freed KF. Non-Gaussian corrections at the .THETA. point: comparison between theory, experiment, and numerical simulations Macromolecules. 18: 821-823. DOI: 10.1021/Ma00146A041 |
0.609 |
|
| 1985 |
Jhon MS, Freed KF. Polymer migration in newtonian fluids Journal of Polymer Science: Polymer Physics Edition. 23: 955-971. DOI: 10.1002/Pol.1985.180230509 |
0.315 |
|
| 1984 |
Singer SJ, Freed KF, Band YB. Dissociation of a diatomic molecule to atomic fine structure states: Electronically nonadiabatic effects upon resonant two-photon dissociation The Journal of Chemical Physics. 81: 3064-3090. DOI: 10.1063/1.448058 |
0.549 |
|
| 1984 |
Hood E, Jedrzejek C, Freed KF, Metiu H. A one‐dimensional model for phonon‐induced desorption. II. Numerical analysis of the desorption of noble gas atoms (argon, krypton, and xenon) from tungsten and carbon monoxide from copper The Journal of Chemical Physics. 81: 3277-3293. DOI: 10.1063/1.448037 |
0.516 |
|
| 1984 |
Singer SJ, Freed KF, Band YB. Cross sections and angular distributions for individual fragment fine structure levels produced in one- and two-photon photodissociation of NaH The Journal of Chemical Physics. 81: 3091-3101. DOI: 10.1063/1.448011 |
0.557 |
|
| 1984 |
Perico A, Freed KF. Dynamics in nonentangled concentrated polymer solutions. II. Model calculations to first order in concentration The Journal of Chemical Physics. 81: 1475-1486. DOI: 10.1063/1.447784 |
0.675 |
|
| 1984 |
Perico A, Freed KF. Dynamics in nonentangled concentrated polymer solutions. I. The full dynamic multiple scattering approach to first order in concentration The Journal of Chemical Physics. 81: 1466-1474. DOI: 10.1063/1.447783 |
0.66 |
|
| 1984 |
Perico A, Buscaglia V, Freed KF. Dynamics in nonentangled concentrated polymers solutions. III. Exact calculations of the frequency dependent relaxation times and normal mode autocorrelation function to first order in concentrations The Journal of Chemical Physics. 81: 6281-6290. DOI: 10.1063/1.447534 |
0.674 |
|
| 1984 |
Takada T, Freed KF. Tests of using large valence spaces in quasidegenerate many‐body perturbation theory: Calculations of O2 potential curves The Journal of Chemical Physics. 80: 3696-3702. DOI: 10.1063/1.447192 |
0.339 |
|
| 1984 |
Takada T, Freed KF. Analysis of the true parameters in the correlated effective valence shell Hamiltonian of Li2 and comparison with semiempirical parameters The Journal of Chemical Physics. 80: 3253-3265. DOI: 10.1063/1.447078 |
0.314 |
|
| 1984 |
Sun H, Freed KF. Ab initio determination of bond length dependence of the correlated valence shell Hamiltonian of CH: Comparison with semiempirical theories The Journal of Chemical Physics. 80: 779-788. DOI: 10.1063/1.446786 |
0.322 |
|
| 1984 |
Kholodenko AL, Freed KF. Theta point (‘‘tricritical’’) region behavior for a polymer chain: Transition to collapse The Journal of Chemical Physics. 80: 900-924. DOI: 10.1063/1.446748 |
0.378 |
|
| 1984 |
Miyake A, Freed KF. Internal chain conformations of star polymers Macromolecules. 17: 678-683. DOI: 10.1021/Ma00134A026 |
0.309 |
|
| 1984 |
Douglas JF, Freed KF. Polydispersity corrections on excluded volume dependence in flexible polymers The Journal of Physical Chemistry. 88: 6613-6617. DOI: 10.1021/J150670A025 |
0.317 |
|
| 1984 |
Freed KF. Mechanism for efficient collision induced intramolecular vibrational relaxation: Comparisons with experiment Chemical Physics Letters. 106: 1-6. DOI: 10.1016/0009-2614(84)87001-3 |
0.331 |
|
| 1984 |
Singer SJ, Freed KF, Band YB. Low-energy resonances in photodissociation of CH+ Chemical Physics Letters. 105: 158-162. DOI: 10.1016/0009-2614(84)85640-7 |
0.528 |
|
| 1984 |
Struve WS, Singer SJ, Freed KF. Photodissociation of homonuclear diatomics: Fine structure cross sections for Na2(X1Σg +) → Na(2S1/2) + Na(2P1/2,3/2 Chemical Physics Letters. 110: 588-592. DOI: 10.1016/0009-2614(84)85468-8 |
0.492 |
|
| 1983 |
Singer SJ, Freed KF, Band YB. Electronic Energy Partitioning in Photodissociation Laser Chemistry. 3: 57-72. DOI: 10.1155/Lc.3.57 |
0.581 |
|
| 1983 |
Kholodenko AL, Freed KF. Direct path-integral treatment of the polaron problem Physical Review B. 27: 4586-4600. DOI: 10.1103/Physrevb.27.4586 |
0.349 |
|
| 1983 |
Lee YS, Freed KF, Sun H, Yeager DL. The correlated pi-Hamiltonian of trans-butadiene as calculated by the ab initio effective valence shell Hamiltonian method: Comparison with semiempirical models The Journal of Chemical Physics. 79: 3862-3873. DOI: 10.1063/1.446252 |
0.508 |
|
| 1983 |
Freed KF. Excluded volume effects in polymers attached to surfaces: Chain conformational renormalization group The Journal of Chemical Physics. 79: 3121-3132. DOI: 10.1063/1.446143 |
0.367 |
|
| 1983 |
Efrima S, Jedrzejek C, Freed KF, Hood E, Metiu H. A one‐dimensional model for phonon‐induced desorption The Journal of Chemical Physics. 79: 2436-2453. DOI: 10.1063/1.446053 |
0.726 |
|
| 1983 |
Lee YS, Freed KF. Correlated effective valence shell Hamiltonian for the first‐row transition metal atoms The Journal of Chemical Physics. 79: 839-851. DOI: 10.1063/1.445860 |
0.334 |
|
| 1983 |
Singer SJ, Freed KF, Band YB. Theory of diatomic molecule photodissociation: Electronic angular momentum influence on fragment and fluorescence cross sections The Journal of Chemical Physics. 79: 6060-6085. DOI: 10.1063/1.445788 |
0.565 |
|
| 1983 |
Freed KF. Concentration and excluded volume dependence of coherent scattering functions for polymers: Chain conformational space renormalization group The Journal of Chemical Physics. 79: 6357-6371. DOI: 10.1063/1.445744 |
0.333 |
|
| 1983 |
Takada T, Sheppard MG, Freed KF. Ab initio effective valence shell Hamiltonian calculations of Li2 potential curves The Journal of Chemical Physics. 79: 325-330. DOI: 10.1063/1.445526 |
0.356 |
|
| 1983 |
Perico A, Freed KF. Multiple scattering theory calculation of the concentration dependence of the tracer and cooperative friction coefficients for Gaussian polymer chains The Journal of Chemical Physics. 78: 2059-2068. DOI: 10.1063/1.444954 |
0.678 |
|
| 1983 |
Freed KF. Concentration dependence of friction coefficients for polymer chains in solution The Journal of Chemical Physics. 78: 2051-2058. DOI: 10.1063/1.444953 |
0.373 |
|
| 1983 |
Kholodenko AL, Freed KF. Renormalization group treatment of excluded volume effects in a polyelectrolyte chain in the weak electrostatic coupling limit The Journal of Chemical Physics. 78: 7412-7428. DOI: 10.1063/1.444732 |
0.347 |
|
| 1983 |
Kholodenko AL, Freed KF. Renormalization group treatment of polymer excluded volume by t’Hooft–Veltman‐type dimensional regularization The Journal of Chemical Physics. 78: 7390-7411. DOI: 10.1063/1.444731 |
0.389 |
|
| 1983 |
Morse MD, Band YB, Freed KF. Angular distributions from photodissociations. V. The bent triatomic molecule The Journal of Chemical Physics. 78: 6066-6078. DOI: 10.1063/1.444568 |
0.548 |
|
| 1983 |
Morse MD, Freed KF. Rotational distributions from photodissociations. IV. The bent triatomic molecule The Journal of Chemical Physics. 78: 6045-6065. DOI: 10.1063/1.444567 |
0.548 |
|
| 1983 |
Muthukumar M, Freed KF. Cluster expansion for concentration dependence of self‐friction coefficients for suspensions of interacting spheres The Journal of Chemical Physics. 78: 497-510. DOI: 10.1063/1.444474 |
0.332 |
|
| 1983 |
Freed KF, Perico A. Concentration dependence of the viscoelastic properties of polymer solutions Faraday Symposia of the Chemical Society. 18: 29. DOI: 10.1039/Fs9831800029 |
0.667 |
|
| 1983 |
Freed KF. Incorporation of excluded volume into the multiple-scattering theory of the concentration dependence of polymer dynamics Macromolecules. 16: 1855-1862. DOI: 10.1021/Ma00246A011 |
0.342 |
|
| 1983 |
Douglas J, Freed KF. Relationship between renormalization group, two parameter theory and blob models of polymer excluded volume Macromolecules. 16: 1800-1802. DOI: 10.1021/Ma00245A022 |
0.33 |
|
| 1983 |
Miyake A, Freed KF. Excluded volume in star polymers: chain conformation space renormalization group Macromolecules. 16: 1228-1241. DOI: 10.1021/Ma00241A035 |
0.304 |
|
| 1983 |
Freed KF. Is there a bridge between ab initio and semiempirical theories of valence? Accounts of Chemical Research. 16: 137-144. DOI: 10.1021/Ar00088A004 |
0.304 |
|
| 1983 |
Lee YS, Freed KF. Ab initio calculations of the π Hamiltonian of trans-butadiene including electron correlations Chemical Physics Letters. 94: 202-204. DOI: 10.1016/0009-2614(83)87574-5 |
0.32 |
|
| 1983 |
Freed KF, Kholodenko AL. Renormalization group description of polymer excluded volume Journal of Statistical Physics. 30: 437-447. DOI: 10.1007/Bf01012317 |
0.359 |
|
| 1982 |
Ohta T, Oono Y, Freed KF. Static-coherent-scattering function for a single polymer chain: Conformational space renormalization of polymers. V Physical Review A. 25: 2801-2811. DOI: 10.1103/Physreva.25.2801 |
0.307 |
|
| 1982 |
Herman MF, Freed KF. Nonadiabatic semiclassical scattering: Atom-diatom collisions in self-consistent matrix propagator formalism The Journal of Chemical Physics. 78: 6010-6020. DOI: 10.1063/1.444617 |
0.542 |
|
| 1982 |
Lee YS, Freed KF. Electron correlation effects on the structure of all 3dn4sm valence states of Ti, V, and Cr and their ions as studied by quasidegenerate many‐body perturbation theory The Journal of Chemical Physics. 77: 1984-2001. DOI: 10.1063/1.444052 |
0.322 |
|
| 1982 |
Singer S, Freed KF, Band YB. Invariant imbedding solution of driven (inhomogeneous) and homogeneous Schrödinger equations The Journal of Chemical Physics. 77: 1942-1950. DOI: 10.1063/1.444048 |
0.514 |
|
| 1982 |
Muthukumar M, Freed KF. Cluster theory for concentration dependence of shear viscosity for suspensions of interacting spheres. II. Calculation of Huggins coefficient The Journal of Chemical Physics. 76: 6195-6201. DOI: 10.1063/1.443022 |
0.329 |
|
| 1982 |
Freed KF, Muthukumar M. Cluster theory for concentration dependence of shear viscosity for suspensions of interacting spheres. I The Journal of Chemical Physics. 76: 6186-6194. DOI: 10.1063/1.443021 |
0.325 |
|
| 1982 |
Sun H, Freed KF. Application of quasidegenerate many‐body perturbation theory to the calculation of molecular excited valence state negative ion Feshbach resonances The Journal of Chemical Physics. 76: 5051-5059. DOI: 10.1063/1.442853 |
0.341 |
|
| 1982 |
Singer SJ, Freed KF, Band YB. Electronic angular momentum effects on photodissociation: fine structure cross sections and angular distributions for NaH → Na(2P 1 2, 3 2) + H(2S 1 2) Chemical Physics Letters. 91: 12-16. DOI: 10.1016/0009-2614(82)87022-X |
0.526 |
|
| 1981 |
Sheppard MG, Freed KF. Convergence studies of the effective valence shell Hamiltonian for correlation energies of the fluorine atom and its ions using third order quasidegenerate many‐body perturbation theory The Journal of Chemical Physics. 75: 4525-4538. DOI: 10.1063/1.442620 |
0.357 |
|
| 1981 |
Sheppard MG, Freed KF. Analysis of ab initio effective valence shell Hamiltonian calculations using third order quasidegenerate many‐body perturbation theory The Journal of Chemical Physics. 75: 4507-4524. DOI: 10.1063/1.442619 |
0.349 |
|
| 1981 |
Oono Y, Freed KF. Conformation space renormalization of polymers. I. Single chain equilibrium properties using Wilson‐type renormalization The Journal of Chemical Physics. 75: 993-1008. DOI: 10.1063/1.442100 |
0.353 |
|
| 1981 |
Oono Y, Freed KF. Conformation space renormalization of polymers. II. Single chain dynamics based on chain diffusion equation model The Journal of Chemical Physics. 75: 1009-1015. DOI: 10.1063/1.442064 |
0.367 |
|
| 1981 |
Morse MD, Freed KF. Rotational and angular distributions from photodissociations. III. Effects of dynamic axis switching in linear triatomic molecules The Journal of Chemical Physics. 74: 4395-4417. DOI: 10.1063/1.441682 |
0.556 |
|
| 1981 |
Michielsen S, Merer AJ, Rice SA, Novak FA, Freed KF, Hamada Y. A study of the rotational state dependence of predissociation of a polyatomic molecule: The case of ClO2 The Journal of Chemical Physics. 74: 3089-3101. DOI: 10.1063/1.441520 |
0.436 |
|
| 1981 |
Sun H, Sheppard MG, Freed KF. Ab initio third order effective valence shell Hamiltonian calculations for first row diatomic hydrides The Journal of Chemical Physics. 74: 6842-6848. DOI: 10.1063/1.441092 |
0.352 |
|
| 1981 |
Oono Y, Ohta T, Freed KF. Application of dimensional regularization to single chain polymer static properties: Conformational space renormalization of polymers. III The Journal of Chemical Physics. 74: 6458-6466. DOI: 10.1063/1.440984 |
0.371 |
|
| 1981 |
Freed KF, Perico A. Considerations on the multiple scattering representation of the concentration dependence of the viscoelastic properties of polymer systems Macromolecules. 14: 1290-1298. DOI: 10.1021/Ma50006A028 |
0.637 |
|
| 1981 |
Lipkin M, Oono Y, Freed KF. Conformation space renormalization of polymers. 4. Equilibrium properties of the simple ring polymer using Gell-Mann-Low type renormalization group theory Macromolecules. 14: 1270-1277. DOI: 10.1021/Ma50006A024 |
0.34 |
|
| 1981 |
Oono Y, Ohta T, Freed KF. Elastic properties of a polymer chain with excluded volume: a renormalization group theory Macromolecules. 14: 880-881. DOI: 10.1021/Ma50004A078 |
0.34 |
|
| 1981 |
Jedrzejek C, Freed KF, Efrima S, Metiu H. A one-dimensional microscopic quantum mechanical theory of light enhanced desorption Surface Science. 109: 191-206. DOI: 10.1016/0039-6028(81)90519-7 |
0.694 |
|
| 1981 |
Sun H, Sheppard MG, Freed KF, Herman MF. First principles test of transferability hypothesis of semi-empirical theories using correlated ab initio effective valence shell hamiltonian methods Chemical Physics Letters. 77: 555-561. DOI: 10.1016/0009-2614(81)85206-2 |
0.526 |
|
| 1981 |
B. Band Y, Freed KF. Dissociation of diatomic molecules into atoms with non-vanishing electronic angular momentum. Theory Chemical Physics Letters. 79: 238-243. DOI: 10.1016/0009-2614(81)80195-9 |
0.301 |
|
| 1981 |
Band YB, Freed KF, Kouri DJ. Dissociation of diatomic molecules into atoms with non-vanishing electronic angular momentum. physical motivation for theory Chemical Physics Letters. 79: 233-237. DOI: 10.1016/0009-2614(81)80194-7 |
0.323 |
|
| 1981 |
Jedrzejek C, Freed KF, Efrima S, Metiu H. A one-dimensional microscopic model for the rate of thermal desorption of an atom. The role of multiphonon processes Chemical Physics Letters. 79: 227-232. DOI: 10.1016/0009-2614(81)80193-5 |
0.713 |
|
| 1980 |
Freed KF, Herman MF, Yeager DL. Critical comparison between equation of motion-green’s function methods and configuration interaction methods: Analysis of methods and applications Physica Scripta. 21: 242-250. DOI: 10.1088/0031-8949/21/3-4/005 |
0.619 |
|
| 1980 |
Freed KF. Concentration dependence of the viscoelastic properties of polymer solutions and suspensions Ferroelectrics. 30: 277-287. DOI: 10.1080/00150198008209523 |
0.343 |
|
| 1980 |
Lee YS, Sun H, Sheppard MG, Freed KF. Ab initio effective valence Hamiltonian description of electron correlation for the neutral and ion valence states of transition metal atoms The Journal of Chemical Physics. 73: 1472-1474. DOI: 10.1063/1.440223 |
0.314 |
|
| 1980 |
Freed KF, Nitzan A. Intramolecular vibrational energy redistribution and the time evolution of molecular fluorescence The Journal of Chemical Physics. 73: 4765-4778. DOI: 10.1063/1.440009 |
0.307 |
|
| 1980 |
Adler RS, Freed KF. On dynamic scaling theories of polymer solutions at nonzero concentrations The Journal of Chemical Physics. 72: 4186-4193. DOI: 10.1063/1.439648 |
0.331 |
|
| 1980 |
Sun H, Freed KF, Herman MF, Yeager DL. Ab initio effective valence shell Hamiltonian for the neutral and ionic valence states of N, O, F, Si, P, and S The Journal of Chemical Physics. 72: 4158-4173. DOI: 10.1063/1.439646 |
0.604 |
|
| 1980 |
Adler RS, Freed KF. Polymer dynamics including side group motion: Free draining limit The Journal of Chemical Physics. 72: 2032-2049. DOI: 10.1063/1.439352 |
0.349 |
|
| 1980 |
Herman MF, Freed KF, Yeager DL, Liu B. Critical test of equation‐of‐motion–Green’s function methods. II. Comparison with configuration interaction results Journal of Chemical Physics. 72: 611-620. DOI: 10.1063/1.438951 |
0.63 |
|
| 1980 |
Herman MF, Freed KF, Yeager DL. Critical test of equation‐of‐motion–Green’s function methods. I. Theory of higher order terms Journal of Chemical Physics. 72: 602-610. DOI: 10.1063/1.438950 |
0.613 |
|
| 1980 |
Freed KF. A Scaling Analysis of Theories of the Viscoelastic Properties of Entangled Polymer Systems Macromolecules. 13: 623-626. DOI: 10.1021/Ma60075A027 |
0.325 |
|
| 1980 |
Yeager DL, Sheppard MG, Freed KF. One-center integrals of the exact effective valence shell Hamiltonian. Empirical analysis for atoms Journal of the American Chemical Society. 102: 1270-1277. DOI: 10.1021/Ja00524A009 |
0.425 |
|
| 1980 |
Morse MD, Freed KF. Rotational distributions in photodissociation: the bent triatomic molecule Chemical Physics Letters. 74: 49-55. DOI: 10.1016/0009-2614(80)85012-3 |
0.541 |
|
| 1980 |
Efrima S, Freed KF, Jedrzejek C, Metiu H. A one-dimensional microscopic model for thermal desorption of an atom. Applications to the case of weak binding Chemical Physics Letters. 74: 43-48. DOI: 10.1016/0009-2614(80)85011-1 |
0.718 |
|
| 1980 |
Freed KF, Sun H. Ab InitioCalculation of One-Center Integrals of Semiempirical Theories of Valence Israel Journal of Chemistry. 19: 99-108. DOI: 10.1002/Ijch.198000010 |
0.325 |
|
| 1980 |
Herman MF, Freed KF, Yeager DL. Critical test of equation-of-motion-Green's function methods. I. Theory of higher order terms The Journal of Chemical Physics. 72: 602-610. |
0.545 |
|
| 1980 |
Herman MF, Freed KF, Yeager DL, Liu B. Critical test of equation-of-motion-Green's function methods. II. Comparison with configuration interaction results The Journal of Chemical Physics. 72: 611-620. |
0.532 |
|
| 1979 |
Freed KF, Kosmas MK. Critical exponents from scaling with neglect of cutoffs Physical Review B. 20: 215-222. DOI: 10.1103/Physrevb.20.215 |
0.603 |
|
| 1979 |
Morse MD, Freed KF, Band YB. Rotational distributions from photodissociation. II. Results for ICN+hν→l+CN(X 2Σ+) The Journal of Chemical Physics. 70: 3620-3629. DOI: 10.1063/1.437965 |
0.547 |
|
| 1979 |
Morse MD, Freed KF, Band YB. Rotational distributions from photodissociations. I. Linear triatomic molecules The Journal of Chemical Physics. 70: 3604-3619. DOI: 10.1063/1.437964 |
0.561 |
|
| 1979 |
Adler RS, Freed KF. On dynamic scaling theories of individual polymers in solution The Journal of Chemical Physics. 70: 3119-3124. DOI: 10.1063/1.437801 |
0.341 |
|
| 1979 |
Muthukumar M, Freed KF. On the Stokes problem for a suspension of spheres at nonzero concentrations. II. Calculations for effective medium theory The Journal of Chemical Physics. 70: 5875-5887. DOI: 10.1063/1.437417 |
0.332 |
|
| 1979 |
Freed KF, Morse MD, Band YB. State-to-state photochemical reaction dynamics in polyatomic molecules Faraday Discussions of the Chemical Society. 67: 297-305. DOI: 10.1039/Dc9796700297 |
0.564 |
|
| 1979 |
Herman MF, Freed KF. Analysis of approximations and errors in equations of motion method calculations Chemical Physics. 36: 383-396. DOI: 10.1016/0301-0104(79)85022-3 |
0.426 |
|
| 1979 |
Sheppard MG, Freed KF, Herman MF, Yeager DL. Generalized perturbation theory of effective valence shell hamiltonians Chemical Physics Letters. 61: 577-582. DOI: 10.1016/0009-2614(79)87176-6 |
0.622 |
|
| 1979 |
Band YB, Morse MD, Freed KF. Fragment angular distributions from photodissociation of polyatomic molecules Chemical Physics Letters. 67: 294-298. DOI: 10.1016/0009-2614(79)85165-9 |
0.533 |
|
| 1978 |
Kosmas MK, Freed KF. On scaling theories of polymer solutions The Journal of Chemical Physics. 69: 3647-3659. DOI: 10.1063/1.437073 |
0.685 |
|
| 1978 |
Band YB, Morse MD, Freed KF. Comparison of semiclassical treatments for evaluating Franck–Condon transition amplitudes for molecular dissociation The Journal of Chemical Physics. 68: 2702. DOI: 10.1063/1.436106 |
0.526 |
|
| 1978 |
Freed KF, Muthukumar M. On the Stokes problem for a suspension of spheres at finite concentrations The Journal of Chemical Physics. 68: 2088-2096. DOI: 10.1063/1.436033 |
0.324 |
|
| 1978 |
Band YB, Freed KF. Design of natural collision coordinates to describe dissociation of polyatomic molecules The Journal of Chemical Physics. 68: 1292-1302. DOI: 10.1063/1.435852 |
0.301 |
|
| 1978 |
Kosmas MK, Freed KF. Self‐consistent field theories of the polymer excluded volume problem. IV. The linear polymer The Journal of Chemical Physics. 68: 4878-4895. DOI: 10.1063/1.435643 |
0.687 |
|
| 1978 |
Freed KF, Metiu H. Mean field theory of the hydrodynamics of concentrated polymer solutions The Journal of Chemical Physics. 68: 4604-4611. DOI: 10.1063/1.435566 |
0.552 |
|
| 1978 |
Muthukumar M, Freed KF. Theory of Concentration Dependence of Polymer Relaxation Times in Dilute Solutions Macromolecules. 11: 843-852. DOI: 10.1021/Ma60065A001 |
0.333 |
|
| 1978 |
Fung KH, Freed KF. Franck-Condon theory of reactive scattering Chemical Physics. 30: 249-267. DOI: 10.1016/0301-0104(78)85123-4 |
0.337 |
|
| 1978 |
Herman MF, Freed KF, Yeager DL. Shake-up peak positions and intensities by many-body theory methods Chemical Physics. 32: 437-449. DOI: 10.1016/0301-0104(78)85025-3 |
0.535 |
|
| 1978 |
Yeager DL, Sun H, Freed KF, Herman MF. Ab initio calculation of the effective valence shell hamiltonian of carbon: Simultaneous treatment of neutral and ion states Chemical Physics Letters. 57: 490-495. DOI: 10.1016/0009-2614(78)85305-6 |
0.595 |
|
| 1978 |
Muthukumar M, Freed KF. Viscosity of random coil polymers with nonzero thickness Chemical Physics Letters. 58: 628-632. DOI: 10.1016/0009-2614(78)80035-9 |
0.52 |
|
| 1977 |
Nitzan A, Freed KF, Cohen MH. Renormalization group and critical localization Physical Review B. 15: 4476-4489. DOI: 10.1103/Physrevb.15.4476 |
0.315 |
|
| 1977 |
Metiu H, Oxtoby DW, Freed KF. Hydrodynamic theory for vibrational relaxation in liquids Physical Review A. 15: 361-371. DOI: 10.1103/Physreva.15.361 |
0.649 |
|
| 1977 |
Metiu H, Freed KF. Bulk viscosity of polymer solutions The Journal of Chemical Physics. 67: 3303-3315. DOI: 10.1063/1.435250 |
0.551 |
|
| 1977 |
Band YB, Freed KF. Energy distribution in selected fragment vibrations in dissociation processes in polyatomic molecules The Journal of Chemical Physics. 67: 1462-1472. DOI: 10.1063/1.435020 |
0.323 |
|
| 1977 |
Adelman SA, Freed KF. Microscopic theory of polymer internal viscosity: Mode coupling approximation for the Rouse model The Journal of Chemical Physics. 67: 1380-1393. DOI: 10.1063/1.435011 |
0.315 |
|
| 1977 |
Muthukumar M, Freed KF. Huggins Coefficient for Polymer Solutions with Excluded Volume Macromolecules. 10: 899-906. DOI: 10.1021/Ma60059A005 |
0.302 |
|
| 1977 |
Yeager DL, Freed KF. Analysis of third order contributions to equations of motion-Green's function excitation energies: application to N2 Chemical Physics. 22: 415-433. DOI: 10.1016/0301-0104(77)89028-9 |
0.337 |
|
| 1977 |
Freed KF, Yeager DL. A wavefunction approach to equations of motion-Green's function methods Chemical Physics. 22: 401-414. DOI: 10.1016/0301-0104(77)89027-7 |
0.305 |
|
| 1977 |
Morse MD, Freed KF, Band YB. Photodissociation: isotope effects and comparisons between theory and experiment Chemical Physics Letters. 49: 399-404. DOI: 10.1016/0009-2614(77)87001-2 |
0.562 |
|
| 1977 |
Herman MF, Yeager DL, Freed KF, McKoy V. Critical analysis of equations-of-motion-Green's function method: Ionization potentials of N2 Chemical Physics Letters. 46: 1-7. DOI: 10.1016/0009-2614(77)85152-X |
0.607 |
|
| 1977 |
Freed KF, Yeager DL, Metiu H. Rotational mechanism for vibrational relaxation in rigid media. Interaction potentials Chemical Physics Letters. 49: 19-23. DOI: 10.1016/0009-2614(77)80433-8 |
0.601 |
|
| 1977 |
Freed KF, Metiu H. Rotational mechanism for vibrational relaxation in rigid media Chemical Physics Letters. 48: 262-266. DOI: 10.1016/0009-2614(77)80311-4 |
0.486 |
|
| 1976 |
Iwata S, Freed KF. Nonclassical terms in the true effective valence shell Hamiltonian: A second quantized formalism Journal of Chemical Physics. 65: 1071-1088. DOI: 10.1063/1.433170 |
0.506 |
|
| 1976 |
Freed KF. Concentration dependence of the translational friction coefficient for polymer solutions The Journal of Chemical Physics. 65: 4103-4110. DOI: 10.1063/1.432865 |
0.323 |
|
| 1976 |
Freed KF. Theory of collision induced intersystem crossing The Journal of Chemical Physics. 64: 1604-1611. DOI: 10.1063/1.432388 |
0.313 |
|
| 1976 |
Freed KF, Edwards SF, Warner M. Excluded volume effect on quasielastic neutron scattering from concentrated polymer solutions The Journal of Chemical Physics. 64: 5132-5141. DOI: 10.1063/1.432188 |
0.335 |
|
| 1976 |
Freed KF. Excluded volume effect on polymer dynamics in concentrated solutions The Journal of Chemical Physics. 64: 5126-5131. DOI: 10.1063/1.432187 |
0.353 |
|
| 1976 |
Band YB, Freed KF. Distribution of vibrational populations of CO electronic states produced in CO2 photodissociation The Journal of Chemical Physics. 64: 4329-4333. DOI: 10.1063/1.432099 |
0.314 |
|
| 1976 |
Tsui FSM, Freed KF. Response function theory of electron correlation Chemical Physics. 14: 27-51. DOI: 10.1016/0301-0104(76)80026-2 |
0.326 |
|
| 1976 |
Hang Fung K, Freed KF. Stochastic model for triplet yields Chemical Physics. 14: 13-26. DOI: 10.1016/0301-0104(76)80025-0 |
0.302 |
|
| 1976 |
Morse MD, F.Freed K, Band YB. Rotational distributions in photodissociation: application to ICN Chemical Physics Letters. 44: 125-130. DOI: 10.1016/0009-2614(76)80425-3 |
0.529 |
|
| 1976 |
Freed KF. Theory of collision induced intersystem crossing. Application to glyoxal Chemical Physics Letters. 37: 47-50. DOI: 10.1016/0009-2614(76)80158-3 |
0.304 |
|
| 1976 |
Iwata S, Freed KF. Analysis of exact valence shell hamiltonian: Nonclassical terms and molecular based parameters Chemical Physics Letters. 38: 425-431. DOI: 10.1016/0009-2614(76)80008-5 |
0.31 |
|
| 1975 |
Laing JR, Freed KF. Semiclassical limit of multichannel scattering theory Physical Review Letters. 34: 849-852. DOI: 10.1103/Physrevlett.34.849 |
0.302 |
|
| 1975 |
Band YB, Freed KF. Dissociation processes of polyatomic molecules The Journal of Chemical Physics. 63: 3382-3397. DOI: 10.1063/1.431775 |
0.334 |
|
| 1975 |
Freed KF, Fong FK. Configuration and interstitial relaxation processes The Journal of Chemical Physics. 63: 2890. DOI: 10.1063/1.431695 |
0.338 |
|
| 1975 |
Gillis HP, Freed KF. Self‐consistent field theories of the polymer excluded volume problem. III. A self‐consistent solution The Journal of Chemical Physics. 63: 852-866. DOI: 10.1063/1.431366 |
0.321 |
|
| 1975 |
Freed KF, Edwards SF. Huggins coefficient for the viscosity of polymer solutions The Journal of Chemical Physics. 62: 4032-4035. DOI: 10.1063/1.430327 |
0.36 |
|
| 1975 |
Freed KF, Edwards SF. Screening regimes for the viscosity of concentrated polymer solutions Journal of the Chemical Society, Faraday Transactions 2. 71: 2025. DOI: 10.1039/F29757102025 |
0.325 |
|
| 1975 |
Iwata S, Freed KF. Solution of large configuration mixing matrices arising in partitioning technique and applications to the generalized eigenvalue problem Chemical Physics. 11: 433-440. DOI: 10.1016/0301-0104(75)80060-7 |
0.329 |
|
| 1974 |
Freed KF, Edwards SF. Polymer viscosity in concentrated solutions The Journal of Chemical Physics. 61: 3626-3633. DOI: 10.1063/1.1682545 |
0.338 |
|
| 1974 |
Iwata S, Freed KF. Ab initio evaluation of correlation contributions to the true π‐electron Hamiltonian: Ethylene The Journal of Chemical Physics. 61: 1500-1509. DOI: 10.1063/1.1682094 |
0.531 |
|
| 1974 |
Edwards SF, Freed KF. Theory of the dynamical viscosity of polymer solutions The Journal of Chemical Physics. 61: 1189-1202. DOI: 10.1063/1.1681993 |
0.376 |
|
| 1974 |
Morokuma K, Freed KF. Exactly solvable model for nonradiative decay with variable coupling strength The Journal of Chemical Physics. 61: 4342-4348. DOI: 10.1063/1.1681741 |
0.441 |
|
| 1974 |
Freed KF, Heller DF. Pressure dependence of electronic relaxation: A stochastic model The Journal of Chemical Physics. 61: 3942-3953. DOI: 10.1063/1.1681687 |
0.635 |
|
| 1974 |
Freed KF. Theoretical foundations of purely semiempirical quantum chemistry The Journal of Chemical Physics. 60: 1765-1788. DOI: 10.1063/1.1681274 |
0.351 |
|
| 1974 |
Prais MG, Heller DF, Freed KF. Nonradiative decay processes in benzene Chemical Physics. 6: 331-352. DOI: 10.1016/0301-0104(74)85019-6 |
0.625 |
|
| 1974 |
Freed KF. Open-shell generalized perturbation theory Chemical Physics. 4: 80-95. DOI: 10.1016/0301-0104(74)80049-2 |
0.36 |
|
| 1974 |
Freed KF. Theoretical Foundations Of Purely Semi-Empirical Quantum Chemistry. III. Repulsion Integrals Chemical Physics Letters. 24: 275-279. DOI: 10.1016/0009-2614(74)85450-3 |
0.318 |
|
| 1974 |
Band YB, Freed KF. Quantum theory of photodissociation of polyatomic molecules: Application to HCN Chemical Physics Letters. 28: 328-334. DOI: 10.1016/0009-2614(74)80360-X |
0.332 |
|
| 1974 |
Freed KF. Theoretical basis for semi-empirical pseudopotentials Chemical Physics Letters. 29: 143-148. DOI: 10.1016/0009-2614(74)80153-3 |
0.303 |
|
| 1974 |
Iwata S, Freed KF. Ab initio calculations of the pi electron hamiltonian: singlet-triplet splittings Chemical Physics Letters. 28: 176-178. DOI: 10.1016/0009-2614(74)80045-X |
0.341 |
|
| 1974 |
IWATA S, FREED KF. ChemInform Abstract: AB INITIO EVALUATION OF CORRELATION CONTRIBUTIONS TO THE TRUE PI-ELECTRON HAMILTONIAN, ETHYLENE Chemischer Informationsdienst. 5. DOI: 10.1002/Chin.197445098 |
0.46 |
|
| 1973 |
Heller DF, Freed KF, Gelbart WM. The role of accepting modes in the theory of nonradiative transitions Chemical Physics Letters. 23: 56-62. DOI: 10.1016/0009-2614(73)89563-6 |
0.746 |
|
| Show low-probability matches. |
