| Year |
Citation |
Score |
| 2017 |
Keolopile ZG, Ryder MR, Calzada B, Gutowski M, Buytendyk AM, Graham JD, Bowen KH. Electrophilicity of oxalic acid monomer is enhanced in the dimer by intermolecular proton transfer. Physical Chemistry Chemical Physics : Pccp. PMID 29105713 DOI: 10.1039/C7Cp00474E |
0.553 |
|
| 2016 |
Ling S, Gutowski M. Different Conformations of 2'-Deoxycytidine in the Gas and Solid Phases: Competition Between Intra- and Intermolecular Hydrogen Bonds. The Journal of Physical Chemistry. A. PMID 27684431 DOI: 10.1021/Acs.Jpca.6B09384 |
0.454 |
|
| 2015 |
Keolopile ZG, Gutowski M, Buonaugurio AM, Collins E, Zhang X, Erb JM, Lectka T, Bowen KH, Allan M. On the Importance of Time Scale and Local Environment in Electron-Driven Proton Transfer. The Anion of Acetoacetic Acid. Journal of the American Chemical Society. PMID 26486969 DOI: 10.1021/Jacs.5B08134 |
0.584 |
|
| 2015 |
Ge Q, Gutowski M. A Comparative Study of Methanol Adsorption and Dissociation over WO3(001) and ReO3(001) Topics in Catalysis. 58: 655-664. DOI: 10.1007/S11244-015-0402-0 |
0.343 |
|
| 2014 |
Buonaugurio A, Graham J, Buytendyk A, Bowen KH, Ryder MR, Keolopile ZG, Haranczyk M, Gutowski M. Communication: Remarkable electrophilicity of the oxalic acid monomer: an anion photoelectron spectroscopy and theoretical study. The Journal of Chemical Physics. 140: 221103. PMID 24929367 DOI: 10.1063/1.4882655 |
0.523 |
|
| 2014 |
Keolopile ZG, Ryder MR, Gutowski M. Intermolecular interactions between molecules in various conformational states: the dimer of oxalic acid. The Journal of Physical Chemistry. A. 118: 7385-91. PMID 24923870 DOI: 10.1021/Jp4125638 |
0.438 |
|
| 2013 |
Keolopile ZG, Gutowski M, Haranczyk M. Discovery of Most Stable Structures of Neutral and Anionic Phenylalanine through Automated Scanning of Tautomeric and Conformational Spaces. Journal of Chemical Theory and Computation. 9: 4374-81. PMID 26589154 DOI: 10.1021/Ct400531A |
0.536 |
|
| 2011 |
Józefowicz M, Aleksiejew M, Abramov AV, Ling S, Gutowski M, Heldt J, Heldt JR. Influence of prototropic reactions on the absorption and fluorescence spectra of methyl p-dimethylaminobenzoate and its two ortho derivatives. Journal of Fluorescence. 21: 1749-62. PMID 21373816 DOI: 10.1007/S10895-011-0870-Y |
0.365 |
|
| 2010 |
Storoniak P, Mazurkiewicz K, Haranczyk M, Gutowski M, Rak J, Eustis SN, Ko YJ, Wang H, Bowen KH. The anionic (9-methyladenine)-(1-methylthymine) base pair solvated by formic acid. A computational and photoelectron spectroscopy study. The Journal of Physical Chemistry. B. 114: 11353-62. PMID 20701309 DOI: 10.1021/Jp104668H |
0.775 |
|
| 2010 |
Eustis SN, Whiteside A, Wang D, Gutowski M, Bowen KH. Ammonia-hydrogen bromide and ammonia-hydrogen iodide complexes: anion photoelectron and ab initio studies. The Journal of Physical Chemistry. A. 114: 1357-63. PMID 20088615 DOI: 10.1021/Jp906238V |
0.75 |
|
| 2010 |
Ko YJ, Wang H, Radisic D, Stokes ST, Eustis SN, Bowen KH, Mazurkiewicz K, Storoniak P, Kowalczyk A, Haranczyk M, Gutowski M, Rak J. Barrier-free proton transfer induced by electron attachment to the complexes between 1-methylcytosine and formic acid Molecular Physics. 108: 2621-2631. DOI: 10.1080/00268976.2010.515623 |
0.773 |
|
| 2009 |
Yu W, Liang L, Lin Z, Ling S, Haranczyk M, Gutowski M. Comparison of some representative density functional theory and wave function theory methods for the studies of amino acids. Journal of Computational Chemistry. 30: 589-600. PMID 18711717 DOI: 10.1002/jcc.21091 |
0.306 |
|
| 2009 |
Abramov A, Gutowski M. Structure and Stability of Hydrogen Clathrates of Ammonia Borane Mrs Proceedings. 1216: 43-51. DOI: 10.1557/Proc-1216-W10-02 |
0.306 |
|
| 2008 |
Haranczyk M, Gutowski M. Visualization of Molecular Orbitals and the Related Electron Densities. Journal of Chemical Theory and Computation. 4: 689-93. PMID 26621083 DOI: 10.1021/Ct800043A |
0.331 |
|
| 2008 |
Bachorz RA, Klopper W, Gutowski M, Li X, Bowen KH. Photoelectron spectrum of valence anions of uracil and first-principles calculations of excess electron binding energies. The Journal of Chemical Physics. 129: 054309. PMID 18698902 DOI: 10.1063/1.2965128 |
0.483 |
|
| 2008 |
Haranczyk M, Gutowski M, Warshel A. Solvation free energies of molecules. The most stable anionic tautomers of uracil. Physical Chemistry Chemical Physics : Pccp. 10: 4442-8. PMID 18654684 DOI: 10.1039/B802300J |
0.512 |
|
| 2008 |
Haranczyk M, Gutowski M. Effect of excess electron and one water molecule on relative stability of the canonical and zwitterionic tautomers of glycine. The Journal of Chemical Physics. 128: 125101. PMID 18376976 DOI: 10.1063/1.2838910 |
0.402 |
|
| 2008 |
Eustis SN, Radisic D, Bowen KH, Bachorz RA, Haranczyk M, Schenter GK, Gutowski M. Electron-driven acid-base chemistry: proton transfer from hydrogen chloride to ammonia. Science (New York, N.Y.). 319: 936-9. PMID 18276886 DOI: 10.1126/Science.1151614 |
0.773 |
|
| 2008 |
Haranczyk M, Holliday J, Willett P, Gutowski M. Structure and singly occupied molecular orbital analysis of anionic tautomers of guanine Journal of Computational Chemistry. 29: 1277-1291. PMID 18161682 DOI: 10.1002/Jcc.20886 |
0.501 |
|
| 2007 |
Haranczyk M, Gutowski M, Li X, Bowen KH. Adiabatically bound valence anions of guanine. The Journal of Physical Chemistry. B. 111: 14073-6. PMID 18052154 DOI: 10.1021/jp077439z |
0.36 |
|
| 2007 |
Li X, Bowen KH, Haranczyk M, Bachorz RA, Mazurkiewicz K, Rak J, Gutowski M. Photoelectron spectroscopy of adiabatically bound valence anions of rare tautomers of the nucleic acid bases. The Journal of Chemical Physics. 127: 174309. PMID 17994820 DOI: 10.1063/1.2795719 |
0.394 |
|
| 2007 |
Harańczyk M, Gutowski M, Li X, Bowen KH. Bound anionic states of adenine. Proceedings of the National Academy of Sciences of the United States of America. 104: 4804-7. PMID 17360375 DOI: 10.1073/pnas.0609982104 |
0.425 |
|
| 2007 |
Bachorz RA, Klopper W, Gutowski M. Coupled-cluster and explicitly correlated perturbation-theory calculations of the uracil anion. The Journal of Chemical Physics. 126: 085101. PMID 17343472 DOI: 10.1063/1.2436890 |
0.421 |
|
| 2007 |
Mazurkiewicz K, Harańczyk M, Gutowski M, Rak J, Radisic D, Eustis SN, Wang D, Bowen KH. Valence anions in complexes of adenine and 9-methyladenine with formic acid: stabilization by intermolecular proton transfer. Journal of the American Chemical Society. 129: 1216-24. PMID 17263404 DOI: 10.1021/Ja066229H |
0.783 |
|
| 2007 |
Mazurkiewicz K, Haranczyk M, Storoniak P, Gutowski M, Rak J, Radisic D, Eustis SN, Wang D, Bowen KH. Intermolecular proton transfer induced by excess electron attachment to adenine(formic acid)n (n = 2, 3) hydrogen-bonded complexes Chemical Physics. 342: 215-222. DOI: 10.1016/J.Chemphys.2007.10.005 |
0.786 |
|
| 2006 |
Mazurkiewicz K, Bachorz RA, Gutowski M, Rak J. On the unusual stability of valence anions of thymine based on very rare tautomers: A computational study. The Journal of Physical Chemistry. B. 110: 24696-707. PMID 17134233 DOI: 10.1021/Jp065666F |
0.47 |
|
| 2006 |
Ling S, Yu W, Huang Z, Lin Z, Harañczyk M, Gutowski M. Gaseous arginine conformers and their unique intramolecular interactions. The Journal of Physical Chemistry. A. 110: 12282-91. PMID 17078626 DOI: 10.1021/jp0645115 |
0.344 |
|
| 2006 |
Bowden M, Kemmitt T, Shaw W, Hess N, Linehan J, Gutowski M, Schmid B, Autrey T. Mechanistic studies of hydrogen release from solid amine borane materials Materials Research Society Symposium Proceedings. 927: 9-14. DOI: 10.1557/Proc-0927-Ee02-04 |
0.362 |
|
| 2005 |
Bachorz RA, Rak J, Gutowski M. Stabilization of very rare tautomers of uracil by an excess electron. Physical Chemistry Chemical Physics : Pccp. 7: 2116-25. PMID 19791402 |
0.426 |
|
| 2005 |
Harańczyk M, Rak J, Gutowski M, Radisic D, Stokes ST, Bowen KH. Intermolecular proton transfer in anionic complexes of uracil with alcohols. The Journal of Physical Chemistry. B. 109: 13383-91. PMID 16852671 DOI: 10.1021/jp050246w |
0.318 |
|
| 2005 |
Dixon DA, Gutowski M. Thermodynamic properties of molecular borane amines and the [BH4-][NH4+] salt for chemical hydrogen storage systems from ab initio electronic structure theory. The Journal of Physical Chemistry. A. 109: 5129-35. PMID 16833867 DOI: 10.1021/Jp0445627 |
0.375 |
|
| 2005 |
Zheng W, Bowen KH, Li J, Dabkowska I, Gutowski M. Electronic structure differences in ZrO2 vs HfO2. The Journal of Physical Chemistry. A. 109: 11521-5. PMID 16354043 DOI: 10.1021/Jp053593E |
0.462 |
|
| 2005 |
Harańczyk M, Rak J, Gutowski M. Stabilization of very rare tautomers of 1-methylcytosine by an excess electron. The Journal of Physical Chemistry. A. 109: 11495-503. PMID 16354040 DOI: 10.1021/jp0535590 |
0.405 |
|
| 2005 |
Miller JH, Aceves-Gaona A, Ernst MB, Haranczyk M, Gutowski M, Vorpagel ER, Dupuis M. Structure and energetics of clustered damage sites Radiation Research. 164: 582-585. PMID 16187792 DOI: 10.1667/Rr3381.1 |
0.361 |
|
| 2005 |
Bachorz RA, Harańczyk M, Dabkowska I, Rak J, Gutowski M. Anion of the formic acid dimer as a model for intermolecular proton transfer induced by a pi* excess electron. The Journal of Chemical Physics. 122: 204304. PMID 15945721 DOI: 10.1063/1.1899144 |
0.562 |
|
| 2005 |
Radisic D, Bowen KH, Dabkowska I, Storoniak P, Rak J, Gutowski M. AT base pair anions versus (9-methyl-A)(1-methyl-T) base pair anions. Journal of the American Chemical Society. 127: 6443-50. PMID 15853352 DOI: 10.1021/ja050724g |
0.413 |
|
| 2005 |
Dabkowska I, Gutowski M, Rak J. Interaction with glycine increases stability of a mutagenic tautomer of uracil. A density functional theory study. Journal of the American Chemical Society. 127: 2238-48. PMID 15713102 DOI: 10.1021/ja048730k |
0.326 |
|
| 2005 |
Haranczyk M, Gutowski M. Valence and dipole-bound anions of the most stable tautomers of guanine. Journal of the American Chemical Society. 127: 699-706. PMID 15643895 DOI: 10.1021/ja046622s |
0.319 |
|
| 2005 |
Dąbkowska I, Rak J, Gutowski M. DNA strand breaks induced by concerted interaction of H radicals and low-energy electrons : A computational study on the nucleotide of cytosine European Physical Journal D. 35: 429-435. DOI: 10.1140/Epjd/E2005-00218-2 |
0.545 |
|
| 2004 |
Dabkowska I, Rak J, Gutowski M, Nilles JM, Stokes ST, Bowen KH. Barrier-free intermolecular proton transfer induced by excess electron attachment to the complex of alanine with uracil. The Journal of Chemical Physics. 120: 6064-71. PMID 15267490 DOI: 10.1063/1.1666042 |
0.478 |
|
| 2004 |
Hay BP, Gutowski M, Dixon DA, Garza J, Vargas R, Moyer BA. Structural criteria for the rational design of selective ligands: convergent hydrogen bonding sites for the nitrate anion. Journal of the American Chemical Society. 126: 7925-34. PMID 15212541 DOI: 10.1021/Ja0487980 |
0.327 |
|
| 2004 |
Dąbkowska I, Rak J, Gutowski M, Nilles JM, Stokes ST, Radisic D, Bowen Jr. KH. Barrier-free proton transfer in anionic complex of thymine with glycine Phys. Chem. Chem. Phys.. 6: 4351-4357. DOI: 10.1039/B406455K |
0.569 |
|
| 2004 |
Harańczyk M, Da̧bkowska I, Rak J, Gutowski M, Nilles JM, Stokes S, Radisic aD, Bowen J§KH. Excess electron attachment induces barrier-free proton transfer in anionic complexes of thymine and uracil with formic acid Journal of Physical Chemistry B. 108: 6919-6921. DOI: 10.1021/Jp0379143 |
0.53 |
|
| 2004 |
Chambers SA, Droubay T, Kaspar TC, Gutowski M, Van Schilfgaarde M. Accurate valence band maximum determination for SrTiO3(0 0 1) Surface Science. 554: 81-89. DOI: 10.1016/J.Susc.2004.02.021 |
0.34 |
|
| 2003 |
Harańczyk M, Bachorz R, Rak aJ, Gutowski M, Radisic D, Stokes ST, Nilles aJM, Bowen KH. Excess electron attachment induces barrier-free proton transfer in binary complexes of uracil with H2Se and H2S but not with H2O Journal of Physical Chemistry B. 107: 7889-7895. DOI: 10.1021/Jp034640A |
0.514 |
|
| 2002 |
Gutowski M, Hall CS, Adamowicz L, Hendricks JH, de Clercq HL, Lyapustina SA, Nilles JM, Xu SJ, Bowen KH. Solvated electrons in very small clusters of polar molecules: (HF)(3)(-). Physical Review Letters. 88: 143001. PMID 11955144 DOI: 10.1103/Physrevlett.88.143001 |
0.522 |
|
| 2002 |
Rak J, Skurski P, Simons J, Gutowski M. Low-energy tautomers and conformers of neutral and protonated arginine. Journal of the American Chemical Society. 123: 11695-707. PMID 11716727 DOI: 10.1021/Ja011357L |
0.441 |
|
| 2002 |
Skurski P, Rak J, Simons J, Gutowski M. Quasidegeneracy of zwitterionic and canonical tautomers of arginine solvated by an excess electron. Journal of the American Chemical Society. 123: 11073-4. PMID 11686717 DOI: 10.1021/Ja011358D |
0.445 |
|
| 2002 |
Gutowski M, Dabkowska I, Rak J, Xu S, Nilles J, Radisic D, Bowen Jr K. Barrier-free intermolecular proton transfer in the uracil-glycine complex induced by excess electron attachment The European Physical Journal D. 20: 431-439. DOI: 10.1140/Epjd/E2002-00168-1 |
0.557 |
|
| 2002 |
Peterson KA, Gutowski M. Electron binding energies of dipole-bound anions at the coupled cluster level with single, double, and triple excitations: HCN- and HNC- Journal of Chemical Physics. 116: 3297-3299. DOI: 10.1063/1.1445743 |
0.486 |
|
| 2001 |
Rak J, Skurski P, Gutowski M. Anab initiostudy of the betaine anion–dipole-bound anionic state of a model zwitterion system The Journal of Chemical Physics. 114: 10673-10681. DOI: 10.1063/1.1373689 |
0.554 |
|
| 2001 |
Skurski P, Gutowski M, Simons J. Ab initio electronic structure of HCN− and HNC− dipole-bound anions and a description of electron loss upon tautomerization The Journal of Chemical Physics. 114: 7443-7449. DOI: 10.1063/1.1358863 |
0.509 |
|
| 2001 |
Skurski P, Gutowski M, Barrios R, Simons J. Non-ionic and zwitterionic forms of neutral arginine – an ab initio study Chemical Physics Letters. 337: 143-150. DOI: 10.1016/S0009-2614(01)00166-X |
0.402 |
|
| 2000 |
Gutowski M, Skurski P, Li X, Wang L. (MgO)(-)(n) (n = 1-5) clusters: multipole-bound anions and photodetachment spectroscopy. Physical Review Letters. 85: 3145-3148. PMID 11019287 DOI: 10.1103/Physrevlett.85.3145 |
0.529 |
|
| 2000 |
Alfonso DR, Snyder JA, Jaffe JE, Hess AC, Gutowski M. Opposite rumpling of the MgO and CaO (100) surfaces: A density-functional theory study Physical Review B - Condensed Matter and Materials Physics. 62: 8318-8322. DOI: 10.1103/Physrevb.62.8318 |
0.336 |
|
| 2000 |
Higgins J, Hollebeek T, Reho J, Ho TS, Lehmann KK, Rabitz H, Scoles G, Gutowski M. On the importance of exchange effects in three-body interactions: The lowest quartet state of Na3 Journal of Chemical Physics. 112: 5751-5761. DOI: 10.1063/1.481150 |
0.366 |
|
| 2000 |
Snyder JA, Jaffe JE, Gutowski M, Lin Z, Hess AC. LDA and GGA calculations of alkali metal adsorption at the (001) surface of MgO Journal of Chemical Physics. 112: 3014-3022. DOI: 10.1063/1.480875 |
0.371 |
|
| 2000 |
Barrios R, Skurski P, Rak J, Gutowski M. Anab initiostudy of (H3B←NH3)−—a dipole-bound anion supported by the dative charge-transfer bond in the neutral host The Journal of Chemical Physics. 113: 8961-8968. DOI: 10.1063/1.1319642 |
0.523 |
|
| 2000 |
Snyder JA, Alfonso DR, Jaffe JE, Lin Z, Hess AC, Gutowski M. Periodic Density Functional LDA and GGA Study of CO Adsorption at the (001) Surface of MgO Journal of Physical Chemistry B. 104: 4717-4722. DOI: 10.1021/Jp000820Y |
0.399 |
|
| 2000 |
Gutowski M, Skurski P, Simons J. Dipole-Bound Anions of Glycine Based on the Zwitterion and Neutral Structures Journal of the American Chemical Society. 122: 10159-10162. DOI: 10.1021/Ja001658F |
0.492 |
|
| 2000 |
Gutowski M, Skurski P, Simons J. Bi-dipole-bound anions International Journal of Mass Spectrometry. 201: 245-252. DOI: 10.1016/S1387-3806(00)00209-8 |
0.453 |
|
| 2000 |
Skurski P, Gutowski M. Excited electronic states of the anion of 7,7,8,8-tetracyanoquinodimethane (TCNQ) Journal of Molecular Structure: Theochem. 531: 339-348. DOI: 10.1016/S0166-1280(00)00467-X |
0.415 |
|
| 2000 |
Snyder JA, Jaffe JE, Lin Z, Hess AC, Gutowski M. Adsorption of CO on MgO supported alkali monolayers: a periodic density functional local density approximation and generalized gradient approximation study Surface Science. 445: 495-505. DOI: 10.1016/S0039-6028(99)01120-6 |
0.372 |
|
| 2000 |
Alfonso DR, Jaffe JE, Hess AC, Gutowski M. High-coverage adsorption of alkali metals at the CaO and MgO(100) surfaces Surface Science. 466: 111-118. DOI: 10.1016/S0039-6028(00)00737-8 |
0.323 |
|
| 2000 |
Alfonso DR, Snyder JA, Jaffe JE, Hess AC, Gutowski M. First-principles studies of adsorption of CO on the Na(100) surface Surface Science. 453: 130-136. DOI: 10.1016/S0039-6028(00)00331-9 |
0.428 |
|
| 2000 |
Skurski P, Gutowski M, Simons J. A bi-dipole-bound dianion Chemical Physics Letters. 322: 175-180. DOI: 10.1016/S0009-2614(00)00350-X |
0.484 |
|
| 2000 |
Skurski P, Gutowski M, Simons J. How to choose a one-electron basis set to reliably describe a dipole-bound anion International Journal of Quantum Chemistry. 80: 1024-1038. DOI: 10.1002/1097-461X(2000)80:4/5<1024::Aid-Qua51>3.0.Co;2-P |
0.494 |
|
| 2000 |
Skurski P, Gutowski M, Simons J. On the possibility of binding of two electrons to dipole potentials International Journal of Quantum Chemistry. 76: 197-204. DOI: 10.1002/(Sici)1097-461X(2000)76:2<197::Aid-Qua9>3.0.Co;2-D |
0.395 |
|
| 1999 |
Skurski P, Gutowski M, Simons J. Mixed valence/dipole-bound dianions The Journal of Chemical Physics. 111: 9469-9474. DOI: 10.1063/1.480277 |
0.466 |
|
| 1999 |
Skurski P, Gutowski M. Ab initio study of the dipole-bound anion (H2O…HCl)− The Journal of Chemical Physics. 111: 3004-3011. DOI: 10.1063/1.479614 |
0.542 |
|
| 1999 |
Skurski P, Gutowski M, Simons J. Theoretical study of the dipole-bound anion (HPPH3)− The Journal of Chemical Physics. 110: 274-280. DOI: 10.1063/1.478062 |
0.35 |
|
| 1999 |
Skurski P, Gutowski M, Simons J. Dipole-Bound Anion of the HNNH3Isomer of Hydrazine. An Ab Initio Study The Journal of Physical Chemistry A. 103: 625-631. DOI: 10.1021/Jp9836776 |
0.499 |
|
| 1999 |
Gutowski M, Skurski P. Theoretical study of the quadrupole-bound anion (BeO)2− Chemical Physics Letters. 303: 65-75. DOI: 10.1016/S0009-2614(99)00172-4 |
0.46 |
|
| 1999 |
Gutowski M, Skurski P. Electron binding energies in linear dipole-bound (HCN)n− (n=2–5) anions Chemical Physics Letters. 300: 331-338. DOI: 10.1016/S0009-2614(98)01377-3 |
0.336 |
|
| 1999 |
Gutowski M. Favorable performance of the DFT methods in predicting the minimum-energy structure of the lowest triplet state of WF4 International Journal of Quantum Chemistry. 73: 369-375. DOI: 10.1002/(Sici)1097-461X(1999)73:4<369::Aid-Qua6>3.0.Co;2-B |
0.457 |
|
| 1998 |
Higgins J, Callegari C, Reho J, Stienkemeier F, Ernst WE, Gutowski M, Scoles G. Helium Cluster Isolation Spectroscopy of Alkali Dimers in the Triplet Manifold The Journal of Physical Chemistry A. 102: 4952-4965. DOI: 10.1021/Jp981115G |
0.344 |
|
| 1998 |
Gutowski M, Jordan KD, Skurski P. Electronic Structure of Dipole-Bound Anions The Journal of Physical Chemistry A. 102: 2624-2633. DOI: 10.1021/JP980123U |
0.344 |
|
| 1998 |
Gutowski M, Jordan KD, Skurski P. Electronic structure of dipole-bound anions Journal of Physical Chemistry A. 102: 2624-2633. DOI: 10.1021/Jp980123U |
0.501 |
|
| 1997 |
Skurski P, Gutowski M. Theoretical study of the dipole-bound anion (HF)2− Journal of Chemical Physics. 108: 6303-6311. DOI: 10.1063/1.476037 |
0.534 |
|
| 1997 |
Gutowski M, Skurski P. Dispersion Stabilization of Solvated Electrons and Dipole-Bound Anions The Journal of Physical Chemistry B. 101: 9143-9146. DOI: 10.1021/Jp972600Z |
0.506 |
|
| 1997 |
Gutowski M, Skurski P, Jordan KD, Simons J. Energies of dipole-bound anionic states International Journal of Quantum Chemistry. 64: 183-191. DOI: 10.1002/(Sici)1097-461X(1997)64:2<183::Aid-Qua5>3.0.Co;2-S |
0.542 |
|
| 1996 |
Higgins J, Ernst WE, Callegari C, Reho J, Lehmann KK, Scoles G, Gutowski M. Spin Polarized Alkali Clusters: Observation of Quartet States of the Sodium Trimer. Physical Review Letters. 77: 4532-4535. PMID 10062562 DOI: 10.1103/Physrevlett.77.4532 |
0.334 |
|
| 1996 |
Gutowski M, Skurski P, Boldyrev AI, Simons J, Jordan KD. Contribution of electron correlation to the stability of dipole-bound anionic states. Physical Review. A. 54: 1906-1909. PMID 9913678 DOI: 10.1103/Physreva.54.1906 |
0.461 |
|
| 1996 |
Higgins J, Callegari C, Reho J, Stienkemeier F, Ernst WE, Lehmann KK, Gutowski M, Scoles G. Photoinduced Chemical Dynamics of High-Spin Alkali Trimers Science (New York, N.Y.). 273: 629-31. PMID 8662549 DOI: 10.1126/Science.273.5275.629 |
0.33 |
|
| 1996 |
Yokoyama K, Leach GW, Kim JB, Lineberger WC, Boldyrev AI, Gutowski M. Autodetachment spectroscopy and dynamics of vibrationally excited dipole‐bound states of H2CCC− The Journal of Chemical Physics. 105: 10706-10718. DOI: 10.1063/1.472879 |
0.365 |
|
| 1996 |
Gutowski M, Boldyrev AI, Simons J, Rak J, Błażejowski J. Properties of Closed-Shell, Octahedral, Multiply-Charged Hexafluorometallates MF63-, M = Sc, Y, La, ZrF62-, and TaF6- Journal of the American Chemical Society. 118: 1173-1180. DOI: 10.1021/Ja952412R |
0.424 |
|
| 1996 |
Boldyrev AI, Gutowski M, Simons J. Small Multiply Charged Anions as Building Blocks in Chemistry Accounts of Chemical Research. 29: 497-502. DOI: 10.1021/Ar960147O |
0.473 |
|
| 1995 |
Gutowski M, Szczȩśniak MM, Chałasínski G. Comment on “A possible definition of basis set superposition error” Chemical Physics Letters. 241: 140-145. DOI: 10.1016/0009-2614(95)00611-7 |
0.367 |
|
| 1995 |
Rak J, Skurski P, Gutowski M, Błażejowski J. Thermodynamics of the thermal decomposition of calcium oxalate monohydrate examined theoretically Journal of Thermal Analysis. 43: 239-246. DOI: 10.1007/Bf02635991 |
0.389 |
|
| 1995 |
Bŀażejowski J, Rak J, Gutowski M. On the possibilities of theoretical analysis of kinetics of the thermal decomposition of solids Journal of Thermal Analysis. 43: 45-55. DOI: 10.1007/Bf02635967 |
0.323 |
|
| 1994 |
Chal/asiński G, Gutowski M, Szcze̢śniak MM, Sadlej J, Scheiner S. Ab initiostudy of He(1S)+Cl2(X 1Σg,3Πu) potential energy surfaces The Journal of Chemical Physics. 101: 6800-6809. DOI: 10.1063/1.468308 |
0.311 |
|
| 1994 |
Gutowski M, Simons J. New anionic states of the lithium trimer Journal of Chemical Physics. 101: 4867-4877. DOI: 10.1063/1.467408 |
0.461 |
|
| 1994 |
Rak J, Gutowski M, Dokurno P, Thanh HV, Bl/ażejowski J. Theoretical studies on structure, thermochemistry, vibrational spectroscopy, and other features of ZrX2−6(X=F,Cl,Br,I): Coulombic energy in inorganic and organic hexahalogenozirconates The Journal of Chemical Physics. 100: 5810-5820. DOI: 10.1063/1.467144 |
0.447 |
|
| 1994 |
Bililign S, Gutowski M, Simons J, Breckenridge WH. Potential energy curves of M(np 2P)⋅RG(2Π) excited states and M+⋅RG ground states (M=Li, Na; RG=He, Ne) The Journal of Chemical Physics. 100: 8212-8218. DOI: 10.1063/1.466764 |
0.347 |
|
| 1994 |
Gutowski M, Simons J. Anionic states of LiFLi The Journal of Chemical Physics. 100: 1308-1311. DOI: 10.1063/1.466660 |
0.445 |
|
| 1994 |
Gutowski M, Boldyrev AI, Ortiz JV, Simons J. Vertical Electron Detachment Energies for Octahedral Closed-Shell Multiply-Charged Anions Journal of the American Chemical Society. 116: 9262-9268. DOI: 10.1021/Ja00099A050 |
0.456 |
|
| 1994 |
Gutowski M, Simons J. Anionic and Neutral States of Li3O The Journal of Physical Chemistry. 98: 8326-8330. DOI: 10.1021/J100085A011 |
0.438 |
|
| 1994 |
Gutowski M, Rak J, Dokurno P, Blazejowski J. Theoretical Studies on the Geometry, Thermochemistry, Vibrational Spectroscopy, and Charge Distribution in TiX62- (X = F, Cl, Br, I). Coulombic Energy in hexahalogenotitanate Lattices The Journal of Physical Chemistry. 98: 6280-6286. DOI: 10.1021/J100076A008 |
0.342 |
|
| 1994 |
Gutowski M, Rak J, Dokurno P, Blazejowksi J. Theoretical Studies on the Structure, Thermochemistry, Vibrational Spectroscopy, and Other Features of HfX62- (X = F, Cl, Br, I). Electrostatic Energy in Hexahalogenohafnates Inorganic Chemistry. 33: 6187-6193. DOI: 10.1021/Ic00104A032 |
0.334 |
|
| 1993 |
Bililign S, Gutowski M, Simons J, Breckenridge WH. Singlet‐to‐triplet energy transfer via 1Π1/3Σ+1 curve crossings in group 2 and 12 metal–atom/rare‐gas systems The Journal of Chemical Physics. 99: 3815-3822. DOI: 10.1063/1.466128 |
0.405 |
|
| 1993 |
Gutowski M, Roberson M, Rusho J, Nichols J, Simons J. Collisional energy transfer in bimolecular ion–molecule dynamics M++(H2; D2; or HD)→(MH++H; MD++D; MH++D; or MD++H) The Journal of Chemical Physics. 99: 2601-2615. DOI: 10.1063/1.465223 |
0.339 |
|
| 1993 |
Gutowski M, van Duijneveldt‐van de Rijdt JGCM, van Lenthe JH, van Duijneveldt FB. Accuracy of the Boys and Bernardi function counterpoise method The Journal of Chemical Physics. 98: 4728-4737. DOI: 10.1063/1.465106 |
0.384 |
|
| 1993 |
Gutowski M, Chal G, asiński. Critical evaluation of some computational approaches to the problem of basis set superposition error Journal of Chemical Physics. 98: 5540-5554. DOI: 10.1063/1.464901 |
0.396 |
|
| 1992 |
Feyereisen M, Gutowski M, Simons J, Almlöf J. Relative stabilities of fullerene, cumulene, and polyacetylene structures for Cn :n=18–60 The Journal of Chemical Physics. 96: 2926-2932. DOI: 10.1063/1.461989 |
0.391 |
|
| 1992 |
Anchell J, Gutowski M, Nichols J, Simons J. Self-Consistent-Field potential-energy surfaces for hydrogen atom pairs within small palladium clusters International Journal of Quantum Chemistry. 41: 793-810. DOI: 10.1002/Qua.560410605 |
0.392 |
|
| 1991 |
Wang XC, Nichols J, Feyereisen M, Gutowski M, Boatz J, Haymet ADJ, Simons J. Ab initio quantum chemistry study of formamide-formamidic acid tautomerization The Journal of Physical Chemistry. 95: 10419-10424. DOI: 10.1021/J100178A032 |
0.308 |
|
| 1991 |
Simons J, Gutowski M. Double-Rydberg molecular anions Chemical Reviews. 91: 669-677. DOI: 10.1021/Cr00005A002 |
0.345 |
|
| 1990 |
Gutowski M, Simons J. Lifetimes of electronically metastable double‐Rydberg anions: FH−2 The Journal of Chemical Physics. 93: 2546-2553. DOI: 10.1063/1.458893 |
0.457 |
|
| 1990 |
Gutowski M, Simons J. Double‐Rydberg anions: Ground‐state electronic and geometric stabilities The Journal of Chemical Physics. 93: 3874-3880. DOI: 10.1063/1.458773 |
0.502 |
|
| 1990 |
Olszewski KA, Gutowski M, Piela L. Interpretation of the hydrogen-bond energy at the Hartree-Fock level for pairs of the hydrogen fluoride, water and ammonia molecules The Journal of Physical Chemistry. 94: 5710-5714. DOI: 10.1021/J100378A020 |
0.443 |
|
| 1990 |
Dick BG, Gutowski M. Quantum Chemical Calculation of Possible Forms of Electronic-Vibrational Coupling for FH(CN−) Defects Physica Status Solidi (a). 117: K115-K118. DOI: 10.1002/Pssa.2211170240 |
0.382 |
|
| 1989 |
Kendall RA, Simons J, Gutowski M, Chalasinski G. The Ab initio energy and structure of hydride-hydrogen (H-(H2)2) The Journal of Physical Chemistry. 93: 621-625. DOI: 10.1021/J100339A024 |
0.338 |
|
| 1988 |
Gutowski M, Piela L. Interpretation of the Hartree-Fock interaction energy between closed-shell systems Molecular Physics. 64: 337-355. DOI: 10.1080/00268978800100263 |
0.376 |
|
| 1988 |
Gutowski M, Simons J, Hernandez R, Taylor HL. "Double-Rydberg" Molecular Anions The Journal of Physical Chemistry. 92: 6179-6182. DOI: 10.1021/J100333A004 |
0.481 |
|
| 1987 |
Gutowski M, Van Duijneveldt FB, Chalasi Ńsk G, Piela L. Proper correction for the basis set superposition error in SCF calculations of intermolecular interactions Molecular Physics. 61: 233-247. DOI: 10.1080/00268978700101101 |
0.378 |
|
| 1987 |
Gutowski M, Verbeek J, van Lenthe JH, Chałasiński G. The impact of higher polarization functions of second-order dispersion energy. Partial wave expansion and damping phenomenon for He2 Chemical Physics. 111: 271-283. DOI: 10.1016/0301-0104(87)80140-4 |
0.338 |
|
| 1986 |
Gutowski M, Van Lenthe JH, Verbeek J, Van Duijneveldt FB, Cha?asinski G. The basis set superposition error in correlated electronic structure calculations Chemical Physics Letters. 124: 370-375. DOI: 10.1016/0009-2614(86)85036-9 |
0.368 |
|
| 1985 |
Chałasiński G, Gutowski M. Dimer centred basis set in the calculations of the first-order interaction energy with CI wavefunction Molecular Physics. 54: 1173-1184. DOI: 10.1080/00268978500100931 |
0.348 |
|
| 1984 |
Gutowski M, Cha?asi??ski G, Van Duijneveldt-Van De Rijdt J. Effective basis sets for calculations of exchange-repulsion energy International Journal of Quantum Chemistry. 26: 971-982. DOI: 10.1002/Qua.560260602 |
0.373 |
|
| 1983 |
Gutowski M, K??lkol M, Piela L. Importance of exchange effects in the deformation of interacting ions International Journal of Quantum Chemistry. 23: 1843-1853. DOI: 10.1002/Qua.560230513 |
0.327 |
|
| 1981 |
Gutowski M, K?kol M, Andzelm J, Piela L. Approximate exchange and electrostatic interaction energies of deformed ions International Journal of Quantum Chemistry. 19: 401-411. DOI: 10.1002/Qua.560190304 |
0.355 |
|
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