Daan Frenkel, PhD - Publications

Affiliations: 
Chemistry University of Cambridge, Cambridge, England, United Kingdom 
Area:
soft condensed matter, simulation techniques
Website:
http://www.knaw.nl/nl/leden/leden/4122

363 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2021 Joseph JA, Espinosa JR, Sanchez-Burgos I, Garaizar A, Frenkel D, Collepardo-Guevara R. Thermodynamics and kinetics of phase separation of protein-RNA mixtures by a minimal model. Biophysical Journal. PMID 33571491 DOI: 10.1016/j.bpj.2021.01.031  0.618
2020 Wang X, Ramírez-Hinestrosa S, Frenkel D. Using Molecular Simulation to Compute Transport Coefficients of Molecular Gases. The Journal of Physical Chemistry. B. 124: 7636-7646. PMID 32790400 DOI: 10.1021/Acs.Jpcb.0C04462  0.346
2020 Espinosa JR, Joseph JA, Sanchez-Burgos I, Garaizar A, Frenkel D, Collepardo-Guevara R. Liquid network connectivity regulates the stability and composition of biomolecular condensates with many components. Proceedings of the National Academy of Sciences of the United States of America. PMID 32482873 DOI: 10.1073/Pnas.1917569117  0.675
2020 Eloul S, Poon WCK, Farago O, Frenkel D. Reactive Momentum Transfer Contributes to the Self-Propulsion of Janus Particles. Physical Review Letters. 124: 188001. PMID 32441974 DOI: 10.1103/Physrevlett.124.188001  0.321
2020 Ramírez-Hinestrosa S, Yoshida H, Bocquet L, Frenkel D. Studying polymer diffusiophoresis with non-equilibrium molecular dynamics Journal of Chemical Physics. 152: 164901. PMID 32357768 DOI: 10.1063/5.0007235  0.303
2020 Wei J, Ramírez-Hinestrosa S, Dobnikar J, Frenkel D. Effect of the interaction strength and anisotropy on the diffusio-phoresis of spherical colloids. Soft Matter. PMID 32101215 DOI: 10.1039/C9Sm02053E  0.311
2020 Zu M, Bupathy A, Frenkel D, Sastry S. Information density, structure and entropy in equilibrium and non-equilibrium systems Journal of Statistical Mechanics: Theory and Experiment. 2020: 23204. DOI: 10.1088/1742-5468/Ab684B  0.331
2019 Espinosa JR, Vega C, Valeriani C, Frenkel D, Sanz E. Heterogeneous versus homogeneous crystal nucleation of hard spheres. Soft Matter. PMID 31613303 DOI: 10.1039/C9Sm01142K  0.808
2019 Proesmans K, Frenkel D. Comparing theory and simulation for thermo-osmosis. The Journal of Chemical Physics. 151: 124109. PMID 31575196 DOI: 10.1063/1.5123164  0.372
2019 Espinosa JR, Garaizar A, Vega C, Frenkel D, Collepardo-Guevara R. Breakdown of the law of rectilinear diameter and related surprises in the liquid-vapor coexistence in systems of patchy particles. The Journal of Chemical Physics. 150: 224510. PMID 31202247 DOI: 10.1063/1.5098551  0.717
2019 Huang W, Wei S, Frenkel D, Huang N. The pathway and kinetics of hierarchical assembly of ionic oligomers into a lyotropic columnar phase. Soft Matter. PMID 30994153 DOI: 10.1039/C9Sm00383E  0.35
2019 Allen MP, Frenkel D. Observation of dynamical precursors of the isotropic-nematic transition by computer simulation. Physical Review Letters. 58: 1748-1750. PMID 10034525 DOI: 10.1103/Physrevlett.58.1748  0.405
2019 Allen MP, Frenkel D. Erratum: Calculation of liquid-crystal Frank constants by computer simulation Physical Review. a, Atomic, Molecular, and Optical Physics. 42: 3641. PMID 9904452 DOI: 10.1103/Physreva.42.3641  0.372
2019 Allen MP, Frenkel D. Calculation of liquid-crystal Frank constants by computer simulation. Physical Review. a, General Physics. 37: 1813-1816. PMID 9899869 DOI: 10.1103/Physreva.37.1813  0.382
2019 Evans R, Frenkel D, Dijkstra M. From simple liquids to colloids and soft matter Physics Today. 72: 38-39. DOI: 10.1063/Pt.3.4135  0.587
2019 Wand C, Fayaz-Torshizi M, Jiménez-Serratos G, Müller E, Frenkel D. Solubilities of pyrene in organic solvents: Comparison between chemical potential calculations using a cavity-based method and direct coexistence simulations The Journal of Chemical Thermodynamics. 131: 620-629. DOI: 10.1016/J.Jct.2018.11.029  0.347
2018 Cumberworth A, Reinhardt A, Frenkel D. Lattice models and Monte Carlo methods for simulating DNA origami self-assembly. The Journal of Chemical Physics. 149: 234905. PMID 30579289 DOI: 10.1063/1.5051835  0.306
2018 Burelbach J, Brückner DB, Frenkel D, Eiser E. Thermophoretic forces on a mesoscopic scale. Soft Matter. PMID 30175826 DOI: 10.1039/C8Sm01132J  0.335
2018 Ganti R, Liu Y, Frenkel D. Hamiltonian Transformation to Compute Thermo-osmotic Forces. Physical Review Letters. 121: 068002. PMID 30141645 DOI: 10.1103/Physrevlett.121.068002  0.451
2018 Wand CR, Totton TS, Frenkel D. Addressing hysteresis and slow equilibration issues in cavity-based calculation of chemical potentials. The Journal of Chemical Physics. 149: 014105. PMID 29981554 DOI: 10.1063/1.5036963  0.332
2018 Wirnsberger P, Dellago C, Frenkel D, Reinhardt A. Theoretical Prediction of Thermal Polarization. Physical Review Letters. 120: 226001. PMID 29906184 DOI: 10.1103/Physrevlett.120.226001  0.321
2018 Curk T, Wirnsberger P, Dobnikar J, Frenkel D, Saric A. Controlling cargo trafficking in multicomponent membranes. Nano Letters. PMID 29667410 DOI: 10.1021/Acs.Nanolett.8B00786  0.578
2018 Liu Y, Ganti R, Frenkel D. Pressure gradients fail to predict diffusio-osmosis. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 30: 205002. PMID 29637907 DOI: 10.1088/1361-648X/Aabd58  0.486
2018 Burelbach J, Frenkel D, Pagonabarraga I, Eiser E. A unified description of colloidal thermophoresis. The European Physical Journal. E, Soft Matter. 41: 7. PMID 29340794 DOI: 10.1140/Epje/I2018-11610-3  0.592
2017 Liu Y, Ganti R, Burton HGA, Zhang X, Wang W, Frenkel D. Microscopic Marangoni Flows Cannot Be Predicted on the Basis of Pressure Gradients. Physical Review Letters. 119: 224502. PMID 29286822 DOI: 10.1103/Physrevlett.119.224502  0.665
2017 Xiao Q, Liu Y, Guo Z, Liu Z, Frenkel D, Dobnikar J, Zhang X. What experiments on pinned nanobubbles can tell about the critical nucleus for bubble nucleation. The European Physical Journal. E, Soft Matter. 40: 114. PMID 29273950 DOI: 10.1140/Epje/I2017-11604-7  0.667
2017 Oh MI, Malevanets A, Paliy M, Frenkel D, Consta S. When droplets become stars: charged dielectric droplets beyond the Rayleigh limit. Soft Matter. PMID 29139530 DOI: 10.1039/C7Sm02017A  0.317
2017 Ganti R, Liu Y, Frenkel D. Molecular Simulation of Thermo-osmotic Slip. Physical Review Letters. 119: 038002. PMID 28777647 DOI: 10.1103/Physrevlett.119.038002  0.558
2017 Frenkel D, Schrenk KJ, Martiniani S. Monte Carlo sampling for stochastic weight functions. Proceedings of the National Academy of Sciences of the United States of America. PMID 28634292 DOI: 10.1073/Pnas.1620497114  0.78
2017 Li L, Totton T, Frenkel D. Computational methodology for solubility prediction: Application to the sparingly soluble solutes. The Journal of Chemical Physics. 146: 214110. PMID 28595415 DOI: 10.1063/1.4983754  0.363
2017 Wirnsberger P, Fijan D, Lightwood RA, Šarić A, Dellago C, Frenkel D. Numerical evidence for thermally induced monopoles. Proceedings of the National Academy of Sciences of the United States of America. PMID 28439003 DOI: 10.1073/Pnas.1621494114  0.607
2017 Jacobs WM, Frenkel D. Phase Transitions in Biological Systems with Many Components. Biophysical Journal. 112: 683-691. PMID 28256228 DOI: 10.1016/J.Bpj.2016.10.043  0.368
2017 Martiniani S, Schrenk KJ, Ramola K, Chakraborty B, Frenkel D. Numerical test of the Edwards conjecture shows that all packings are equally probable at jamming Nature Physics. 13: 848-851. DOI: 10.1038/Nphys4168  0.363
2017 Vernon A, Fenimore P, Strauss C, Tung C, Frenkel D, Terentjev E. Using Molecular Dynamics Simulations to Understand Pattern Formation in Polymers Biophysical Journal. 112: 54a. DOI: 10.1016/J.Bpj.2016.11.330  0.345
2016 Šarić A, Buell AK, Meisl G, Michaels TCT, Dobson CM, Linse S, Knowles TPJ, Frenkel D. Physical determinants of the self-replication of protein fibrils. Nature Physics. 12: 874-880. PMID 31031819 DOI: 10.1038/Nphys3828  0.593
2016 Kelton KF, Frenkel D. Preface: Special Topic on Nucleation: New Concepts and Discoveries. The Journal of Chemical Physics. 145: 211501. PMID 28799387 DOI: 10.1063/1.4967522  0.341
2016 Šarić A, Michaels TCT, Zaccone A, Knowles TPJ, Frenkel D. Kinetics of spontaneous filament nucleation via oligomers: Insights from theory and simulation. The Journal of Chemical Physics. 145: 211926. PMID 28799382 DOI: 10.1063/1.4965040  0.634
2016 Martiniani S, Schrenk KJ, Stevenson JD, Wales DJ, Frenkel D. Structural analysis of high-dimensional basins of attraction. Physical Review. E. 94: 031301. PMID 27739758 DOI: 10.1103/Physreve.94.031301  0.787
2016 Reinhardt A, Frenkel D. DNA brick self-assembly with an off-lattice potential. Soft Matter. PMID 27378398 DOI: 10.1039/C6Sm01031H  0.3
2016 Frenkel D, Louët S. Interview with Daan Frenkel, Boltzmann Medallist 2016 : Simulating soft matter through the lens of statistical mechanics. The European Physical Journal. E, Soft Matter. 39: 68. PMID 27349557 DOI: 10.1140/Epje/I2016-16068-7  0.319
2016 Martiniani S, Schrenk KJ, Stevenson JD, Wales DJ, Frenkel D. Turning intractable counting into sampling: Computing the configurational entropy of three-dimensional jammed packings. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 93: 012906. PMID 26871142 DOI: 10.1103/Physreve.93.012906  0.782
2016 Wirnsberger P, Fijan D, Šarić A, Neumann M, Dellago C, Frenkel D. Non-equilibrium simulations of thermally induced electric fields in water Journal of Chemical Physics. 144. DOI: 10.1063/1.4953036  0.305
2015 Schrenk KJ, Frenkel D. Communication: Evidence for non-ergodicity in quiescent states of periodically sheared suspensions. The Journal of Chemical Physics. 143: 241103. PMID 26723582 DOI: 10.1063/1.4938999  0.356
2015 Jacobs WM, Frenkel D. Self-assembly protocol design for periodic multicomponent structures. Soft Matter. PMID 26404794 DOI: 10.1039/C5Sm01841B  0.313
2015 Collepardo-Guevara R, Portella G, Vendruscolo M, Frenkel D, Schlick T, Orozco M. Chromatin Unfolding by Epigenetic Modifications Explained by Dramatic Impairment of Internucleosome Interactions: A Multiscale Computational Study. Journal of the American Chemical Society. 137: 10205-15. PMID 26192632 DOI: 10.1021/Jacs.5B04086  0.709
2015 Jacobs WM, Reinhardt A, Frenkel D. Rational design of self-assembly pathways for complex multicomponent structures. Proceedings of the National Academy of Sciences of the United States of America. 112: 6313-8. PMID 25941388 DOI: 10.1073/Pnas.1502210112  0.3
2015 Merlet C, Forse AC, Griffin JM, Frenkel D, Grey CP. Lattice simulation method to model diffusion and NMR spectra in porous materials. The Journal of Chemical Physics. 142: 094701. PMID 25747093 DOI: 10.1063/1.4913368  0.303
2015 van Meel JA, Liu Y, Frenkel D. Mechanism of two-step vapour–crystal nucleation in a pore Molecular Physics. DOI: 10.1080/00268976.2015.1031844  0.547
2014 Vácha R, Frenkel D. Stability of bicelles: a simulation study. Langmuir : the Acs Journal of Surfaces and Colloids. 30: 4229-35. PMID 24670113 DOI: 10.1021/La4048159  0.334
2014 Martinez-Veracoechea FJ, Mognetti BM, Angioletti-Uberti S, Varilly P, Frenkel D, Dobnikar J. Designing stimulus-sensitive colloidal walkers. Soft Matter. 10: 3463-70. PMID 24647520 DOI: 10.1039/C3Sm53096E  0.303
2014 Martiniani S, Stevenson JD, Wales DJ, Frenkel D. Superposition enhanced nested sampling Physical Review X. 4. DOI: 10.1103/Physrevx.4.031034  0.377
2013 Mognetti BM, Sari? A, Angioletti-Uberti S, Cacciuto A, Valeriani C, Frenkel D. Living clusters and crystals from low-density suspensions of active colloids. Physical Review Letters. 111: 245702. PMID 24483677 DOI: 10.1103/Physrevlett.111.245702  0.658
2013 Levesque M, Duvail M, Pagonabarraga I, Frenkel D, Rotenberg B. Accounting for adsorption and desorption in lattice Boltzmann simulations. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 88: 013308. PMID 23944584 DOI: 10.1103/Physreve.88.013308  0.568
2013 Jacobs WM, Frenkel D. Predicting phase behavior in multicomponent mixtures. The Journal of Chemical Physics. 139: 024108. PMID 23862930 DOI: 10.1063/1.4812461  0.411
2013 Albertazzi L, Martinez-Veracoechea FJ, Leenders CM, Voets IK, Frenkel D, Meijer EW. Spatiotemporal control and superselectivity in supramolecular polymers using multivalency. Proceedings of the National Academy of Sciences of the United States of America. 110: 12203-8. PMID 23836666 DOI: 10.1073/Pnas.1303109110  0.521
2013 Asenjo D, Stevenson JD, Wales DJ, Frenkel D. Visualizing basins of attraction for different minimization algorithms. The Journal of Physical Chemistry. B. 117: 12717-23. PMID 23659176 DOI: 10.1021/Jp312457A  0.431
2013 Angioletti-Uberti S, Varilly P, Mognetti BM, Tkachenko AV, Frenkel D. Communication: a simple analytical formula for the free energy of ligand-receptor-mediated interactions. The Journal of Chemical Physics. 138: 021102. PMID 23320658 DOI: 10.1063/1.4775806  0.302
2013 Frenkel D, Asenjo D, Paillusson F. The other entropy Molecular Physics. 111: 3641-3650. DOI: 10.1080/00268976.2013.844868  0.328
2013 Mladek BM, Fornleitner J, Martinez-Veracoechea FJ, Dawid A, Frenkel D. Procedure to construct a multi-scale coarse-grained model of DNA-coated colloids from experimental data Soft Matter. 9: 7342-7355. DOI: 10.1039/C3Sm50701G  0.306
2013 Curk T, Martinez-Veracoechea FJ, Frenkel D, Dobnikar J. Collective ordering of colloids in grafted polymer layers Soft Matter. 9: 5565-5571. DOI: 10.1039/C3Sm50486G  0.321
2012 Malgaretti P, Pagonabarraga I, Frenkel D. Running faster together: huge speed up of thermal ratchets due to hydrodynamic coupling. Physical Review Letters. 109: 168101. PMID 23215133 DOI: 10.1103/Physrevlett.109.168101  0.55
2012 Frenkel D. Colloidal crystals full of invisible vacancies. Proceedings of the National Academy of Sciences of the United States of America. 109: 17728-9. PMID 23077254 DOI: 10.1073/Pnas.1215398109  0.333
2012 Bieler NS, Knowles TP, Frenkel D, Vácha R. Connecting macroscopic observables and microscopic assembly events in amyloid formation using coarse grained simulations. Plos Computational Biology. 8: e1002692. PMID 23071427 DOI: 10.1371/Journal.Pcbi.1002692  0.326
2012 Mladek BM, Fornleitner J, Martinez-Veracoechea FJ, Dawid A, Frenkel D. Quantitative prediction of the phase diagram of DNA-functionalized nanosized colloids. Physical Review Letters. 108: 268301. PMID 23005018 DOI: 10.1103/Physrevlett.108.268301  0.375
2012 van Meel JA, Filion L, Valeriani C, Frenkel D. A parameter-free, solid-angle based, nearest-neighbor algorithm. The Journal of Chemical Physics. 136: 234107. PMID 22779581 DOI: 10.1063/1.4729313  0.779
2012 Angioletti-Uberti S, Mognetti BM, Frenkel D. Re-entrant melting as a design principle for DNA-coated colloids. Nature Materials. 11: 518-22. PMID 22543302 DOI: 10.1038/Nmat3314  0.336
2012 Curk T, de Hoogh A, Martinez-Veracoechea FJ, Eiser E, Frenkel D, Dobnikar J, Leunissen ME. Layering, freezing, and re-entrant melting of hard spheres in soft confinement. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 85: 021502. PMID 22463214 DOI: 10.1103/Physreve.85.021502  0.416
2012 Frenkel D. Simulations: The dark side Proceedings of the International School of Physics "Enrico Fermi". 184: 195-227. DOI: 10.1140/Epjp/I2013-13010-8  0.309
2012 Dorsaz N, Filion L, Smallenburg F, Frenkel D. Spiers memorial lecture: Effect of interaction specificity on the phase behaviour of patchy particles Faraday Discussions. 159: 9-21. DOI: 10.1039/C2Fd20070H  0.396
2012 Sengupta A, Hammond PS, Frenkel D, Boek ES. Error analysis and correction for Lattice Boltzmann simulated flow conductance in capillaries of different shapes and alignments Journal of Computational Physics. 231: 2634-2640. DOI: 10.1016/J.Jcp.2011.12.004  0.306
2011 Vácha R, Frenkel D. Relation between molecular shape and the morphology of self-assembling aggregates: a simulation study. Biophysical Journal. 101: 1432-9. PMID 21943424 DOI: 10.1016/J.Bpj.2011.07.046  0.341
2011 Martinez-Veracoechea FJ, Mladek BM, Tkachenko AV, Frenkel D. Design rule for colloidal crystals of DNA-functionalized particles. Physical Review Letters. 107: 045902. PMID 21867023 DOI: 10.1103/Physrevlett.107.045902  0.372
2011 Xu N, Frenkel D, Liu AJ. Direct determination of the size of basins of attraction of jammed solids. Physical Review Letters. 106: 245502. PMID 21770580 DOI: 10.1103/Physrevlett.106.245502  0.33
2011 Frenkel D, Wales DJ. Colloidal self-assembly: designed to yield. Nature Materials. 10: 410-1. PMID 21602872 DOI: 10.1038/Nmat3037  0.506
2011 Zhu L, Frenkel D, Bolhuis PG. Role of fluctuations in ligand binding cooperativity of membrane receptors. Physical Review Letters. 106: 168103. PMID 21599417 DOI: 10.1103/Physrevlett.106.168103  0.763
2011 Filion L, Ni R, Frenkel D, Dijkstra M. Simulation of nucleation in almost hard-sphere colloids: the discrepancy between experiment and simulation persists. The Journal of Chemical Physics. 134: 134901. PMID 21476768 DOI: 10.1063/1.3572059  0.729
2011 Leunissen ME, Frenkel D. Numerical study of DNA-functionalized microparticles and nanoparticles: explicit pair potentials and their implications for phase behavior. The Journal of Chemical Physics. 134: 084702. PMID 21361551 DOI: 10.1063/1.3557794  0.349
2011 Abeln S, Frenkel D. Accounting for protein-solvent contacts facilitates design of nonaggregating lattice proteins. Biophysical Journal. 100: 693-700. PMID 21281584 DOI: 10.1016/J.Bpj.2010.11.088  0.303
2010 van Meel JA, Sear RP, Frenkel D. Design principles for broad-spectrum protein-crystal nucleants with nanoscale pits. Physical Review Letters. 105: 205501. PMID 21231245 DOI: 10.1103/Physrevlett.105.205501  0.305
2010 Pagonabarraga I, Rotenberg B, Frenkel D. Recent advances in the modelling and simulation of electrokinetic effects: bridging the gap between atomistic and macroscopic descriptions. Physical Chemistry Chemical Physics : Pccp. 12: 9566-80. PMID 20607194 DOI: 10.1039/C004012F  0.57
2010 Rotenberg B, Pagonabarraga I, Frenkel D. Coarse-grained simulations of charge, current and flow in heterogeneous media. Faraday Discussions. 144: 223-43; discussion 3. PMID 20158031 DOI: 10.1039/B901553A  0.552
2010 Martinez-Veracoechea FJ, Bozorgui B, Frenkel D. Anomalous phase behavior of liquid-vapor phase transition in binary mixtures of DNA-coated particles Soft Matter. 6: 6136-6145. DOI: 10.1039/C0Sm00567C  0.426
2010 Verde AV, Frenkel D. Simulation study of micelle formation by bile salts Soft Matter. 6: 3815-3825. DOI: 10.1039/C0Sm00011F  0.33
2009 Pàmies JC, Cacciuto A, Frenkel D. Erratum: "Phase diagram of Hertzian spheres" [J. Chem. Phys. 131, 044514 (2009)]. The Journal of Chemical Physics. 131: 159903. PMID 19852533 DOI: 10.1063/1.3251048  0.672
2009 Pàmies JC, Cacciuto A, Frenkel D. Phase diagram of Hertzian spheres. The Journal of Chemical Physics. 131: 044514. PMID 19655901 DOI: 10.1063/1.3186742  0.727
2009 Gribova NV, Fomin YD, Frenkel D, Ryzhov VN. Waterlike thermodynamic anomalies in a repulsive-shoulder potential system. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 79: 051202. PMID 19518442 DOI: 10.1103/Physreve.79.051202  0.433
2009 van Meel JA, Frenkel D, Charbonneau P. Geometrical frustration: a study of four-dimensional hard spheres. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 79: 030201. PMID 19391883 DOI: 10.1103/Physreve.79.030201  0.557
2009 Wang ZJ, Valeriani C, Frenkel D. Homogeneous bubble nucleation driven by local hot spots: a molecular dynamics study. The Journal of Physical Chemistry. B. 113: 3776-84. PMID 19007279 DOI: 10.1021/Jp807727P  0.795
2008 van Meel JA, Page AJ, Sear RP, Frenkel D. Two-step vapor-crystal nucleation close below triple point. The Journal of Chemical Physics. 129: 204505. PMID 19045871 DOI: 10.1063/1.3026364  0.409
2008 Allen RJ, Valeriani C, T?nase-Nicola S, ten Wolde PR, Frenkel D. Homogeneous nucleation under shear in a two-dimensional Ising model: cluster growth, coalescence, and breakup. The Journal of Chemical Physics. 129: 134704. PMID 19045113 DOI: 10.1063/1.2981052  0.776
2008 Bozorgui B, Frenkel D. Liquid-vapor transition driven by bond disorder. Physical Review Letters. 101: 045701. PMID 18764339 DOI: 10.1103/Physrevlett.101.045701  0.377
2008 Charbonneau P, Das C, Frenkel D. Dynamical heterogeneity in a glass-forming ideal gas. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 78: 011505. PMID 18763959 DOI: 10.1103/Physreve.78.011505  0.543
2008 Fomin YD, Gribova NV, Ryzhov VN, Stishov SM, Frenkel D. Quasibinary amorphous phase in a three-dimensional system of particles with repulsive-shoulder interactions. The Journal of Chemical Physics. 129: 064512. PMID 18715090 DOI: 10.1063/1.2965880  0.436
2008 Rotenberg B, Pagonabarraga I, Frenkel D. Dispersion of charged tracers in charged porous media Epl. 83. DOI: 10.1209/0295-5075/83/34004  0.541
2008 Sanz E, Valeriani C, Vissers T, Fortini A, Leunissen ME, Van Blaaderen A, Frenkel D, Dijkstra M. Out-of-equilibrium processes in suspensions of oppositely charged colloids: Liquid-to-crystal nucleation and gel formation Journal of Physics Condensed Matter. 20. DOI: 10.1088/0953-8984/20/49/494247  0.678
2008 Mladek BM, Charbonneau P, Likos CN, Frenkel D, Kahl G. Multiple occupancy crystals formed by purely repulsive soft particles Journal of Physics Condensed Matter. 20. DOI: 10.1088/0953-8984/20/49/494245  0.565
2008 Van Meel JA, Arnold A, Frenkel D, Portegies Zwart SF, Belleman RG. Harvesting graphics power for MD simulations Molecular Simulation. 34: 259-266. DOI: 10.1080/08927020701744295  0.315
2008 Ghiringhelli LM, Valeriani C, Los JH, Meijer EJ, Fasolino A, Frenkel D. State-of-the-art models for the phase diagram of carbon and diamond nucleation Molecular Physics. 106: 2011-2038. DOI: 10.1080/00268970802077884  0.573
2008 Frenkel D. Random organization: Ordered chaos Nature Physics. 4: 345-346. DOI: 10.1038/Nphys973  0.322
2007 Mladek BM, Charbonneau P, Frenkel D. Phase coexistence of cluster crystals: beyond the Gibbs phase rule. Physical Review Letters. 99: 235702. PMID 18233385 DOI: 10.1103/Physrevlett.99.235702  0.614
2007 Arnold A, Bozorgui B, Frenkel D, Ha BY, Jun S. Unexpected relaxation dynamics of a self-avoiding polymer in cylindrical confinement. The Journal of Chemical Physics. 127: 164903. PMID 17979390 DOI: 10.1063/1.2799513  0.327
2007 Ghiringhelli LM, Valeriani C, Meijer EJ, Frenkel D. Local structure of liquid carbon controls diamond nucleation. Physical Review Letters. 99: 055702. PMID 17930770 DOI: 10.1103/Physrevlett.99.055702  0.57
2007 Sanz E, Valeriani C, Frenkel D, Dijkstra M. Evidence for out-of-equilibrium crystal nucleation in suspensions of oppositely charged colloids. Physical Review Letters. 99: 055501. PMID 17930766 DOI: 10.1103/Physrevlett.99.055501  0.793
2007 Valeriani C, Allen RJ, Morelli MJ, Frenkel D, Rein ten Wolde P. Computing stationary distributions in equilibrium and nonequilibrium systems with forward flux sampling. The Journal of Chemical Physics. 127: 114109. PMID 17887830 DOI: 10.1063/1.2767625  0.776
2007 Charbonneau P, Frenkel D. Gas-solid coexistence of adhesive spheres. The Journal of Chemical Physics. 126: 196101. PMID 17523839 DOI: 10.1063/1.2737051  0.522
2007 Bozorgui B, Frenkel D. Lattice-based Monte Carlo method for telechelic chain molecules. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 75: 036708. PMID 17500827 DOI: 10.1103/Physreve.75.036708  0.329
2007 Valeriani C, Wang ZJ, Frenkel D. Comparison of simple perturbation-theory estimates for the liquid-solid and the liquid-vapor interfacial free energies of Lennard-Jones systems Molecular Simulation. 33: 1023-1028. DOI: 10.1080/08927020701579352  0.363
2006 Prinsen P, Pàmies JC, Odijk T, Frenkel D. Application of the optimized Baxter model to the hard-core attractive Yukawa system. The Journal of Chemical Physics. 125: 194506. PMID 17129122 DOI: 10.1063/1.2390699  0.363
2006 Frenkel D. Materials science. Colloidal encounters: a matter of attraction. Science (New York, N.Y.). 314: 768-9. PMID 17082442 DOI: 10.1126/Science.1135544  0.332
2006 Frenkel D. Physical chemistry: seeds of phase change. Nature. 443: 641. PMID 17035987 DOI: 10.1038/443641A  0.366
2006 Capuani F, Pagonabarraga I, Frenkel D. Lattice-Boltzmann simulation of the sedimentation of charged disks. The Journal of Chemical Physics. 124: 124903. PMID 16599721 DOI: 10.1063/1.2178804  0.553
2006 Allen RJ, Frenkel D, ten Wolde PR. Simulating rare events in equilibrium or nonequilibrium stochastic systems. The Journal of Chemical Physics. 124: 024102. PMID 16422566 DOI: 10.1063/1.2140273  0.393
2006 Valeriani C, Sanz E, Frenkel D. Rate of homogeneous crystal nucleation in molten NaCl. The Journal of Chemical Physics. 122: 194501. PMID 16161591 DOI: 10.1063/1.1896348  0.382
2006 Auer S, Frenkel D. Numerical prediction of absolute crystallization rates in hard-sphere colloids. The Journal of Chemical Physics. 120: 3015-29. PMID 15268449 DOI: 10.1063/1.1638740  0.361
2006 Wijmans CM, Eiser E, Frenkel D. Simulation study of intra- and intermicellar ordering in triblock-copolymer systems. The Journal of Chemical Physics. 120: 5839-48. PMID 15267463 DOI: 10.1063/1.1649730  0.378
2006 Lukatsky DB, Mulder BM, Frenkel D. Designing ordered DNA-linked nanoparticle assemblies Journal of Physics Condensed Matter. 18: S567-S580. DOI: 10.1088/0953-8984/18/18/S05  0.733
2005 Boulougouris GC, Frenkel D. Monte Carlo Sampling of a Markov Web. Journal of Chemical Theory and Computation. 1: 389-93. PMID 26641505 DOI: 10.1021/Ct049900M  0.316
2005 Cacciuto A, Frenkel D. Stresses inside critical nuclei. The Journal of Physical Chemistry. B. 109: 6587-94. PMID 16851739 DOI: 10.1021/Jp0456483  0.69
2005 Cacciuto A, Frenkel D. Simulation of colloidal crystallization on finite structured templates. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 72: 041604. PMID 16383393 DOI: 10.1103/Physreve.72.041604  0.676
2005 Boulougouris GC, Frenkel D. Novel Monte Carlo scheme for systems with short-ranged interactions. The Journal of Chemical Physics. 122: 244106. PMID 16035745 DOI: 10.1063/1.1931652  0.339
2005 Wang ZJ, Frenkel D. Modeling flexible amphiphilic bilayers: a solvent-free off-lattice Monte Carlo study. The Journal of Chemical Physics. 122: 234711. PMID 16008477 DOI: 10.1063/1.1927509  0.348
2005 Ghiringhelli LM, Los JH, Meijer EJ, Fasolino A, Frenkel D. Modeling the phase diagram of carbon. Physical Review Letters. 94: 145701. PMID 15904077 DOI: 10.1103/Physrevlett.94.145701  0.601
2005 van Ketel W, Das C, Frenkel D. Structural arrest in an ideal gas. Physical Review Letters. 94: 135703. PMID 15904005 DOI: 10.1103/Physrevlett.94.135703  0.312
2005 Schilling T, Pronk S, Mulder B, Frenkel D. Monte Carlo study of hard pentagons. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 71: 036138. PMID 15903524 DOI: 10.1103/Physreve.71.036138  0.765
2005 Koster G, Cacciuto A, Derényi I, Frenkel D, Dogterom M. Force barriers for membrane tube formation. Physical Review Letters. 94: 068101. PMID 15783778 DOI: 10.1103/Physrevlett.94.068101  0.639
2005 Hu W, Frenkel D. Oriented primary crystal nucleation in lamellar diblock copolymer systems. Faraday Discussions. 128: 253-60. PMID 15658777 DOI: 10.1039/B403003F  0.339
2005 Dijkstra M, Roij Rv, Vroege GJ, Lekkerkerker H, Frenkel D. 6th Liquid Matter Conference Journal of Physics: Condensed Matter. 17. DOI: 10.1088/0953-8984/17/45/E01  0.606
2005 Ghiringhelli LM, Los JH, Meijer EJ, Fasolino A, Frenkel D. Liquid carbon: Structure near the freezing line Journal of Physics Condensed Matter. 17: S3619-S3624. DOI: 10.1088/0953-8984/17/45/056  0.57
2005 Pagonabarraga I, Capuani F, Frenkel D. Mesoscopic lattice modeling of electrokinetic phenomena Computer Physics Communications. 169: 192-196. DOI: 10.1016/J.Cpc.2005.03.043  0.546
2005 Schilling T, Frenkel D. Nucleation in suspensions of anisotropic colloids Computer Physics Communications. 169: 117-121. DOI: 10.1016/J.Cpc.2005.03.028  0.364
2004 Frenkel D. Speed-up of Monte Carlo simulations by sampling of rejected states. Proceedings of the National Academy of Sciences of the United States of America. 101: 17571-5. PMID 15591337 DOI: 10.1073/Pnas.0407950101  0.344
2004 Cacciuto A, Auer S, Frenkel D. Breakdown of classical nucleation theory near isostructural phase transitions. Physical Review Letters. 93: 166105. PMID 15525010 DOI: 10.1103/Physrevlett.93.166105  0.691
2004 Blaak R, Auer S, Frenkel D, Löwen H. Crystal nucleation of colloidal suspensions under shear. Physical Review Letters. 93: 068303. PMID 15323669 DOI: 10.1103/Physrevlett.93.068303  0.672
2004 Pronk S, Frenkel D. Large effect of polydispersity on defect concentrations in colloidal crystals. The Journal of Chemical Physics. 120: 6764-8. PMID 15267571 DOI: 10.1063/1.1667880  0.309
2004 Blaak R, Mulder BM, Frenkel D. Cubatic phase for tetrapods. The Journal of Chemical Physics. 120: 5486-92. PMID 15267423 DOI: 10.1063/1.1649733  0.802
2004 Capuani F, Pagonabarraga I, Frenkel D. Discrete solution of the electrokinetic equations. The Journal of Chemical Physics. 121: 973-86. PMID 15260630 DOI: 10.1063/1.1760739  0.545
2004 Miller MA, Frenkel D. Phase diagram of the adhesive hard sphere fluid. The Journal of Chemical Physics. 121: 535-45. PMID 15260575 DOI: 10.1063/1.1758693  0.386
2004 Pronk S, Frenkel D. Melting of polydisperse hard disks. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 69: 066123. PMID 15244683 DOI: 10.1103/Physreve.69.066123  0.359
2004 Auer S, Frenkel D. Quantitative prediction of crystal-nucleation rates for spherical colloids: a computational approach. Annual Review of Physical Chemistry. 55: 333-61. PMID 15117256 DOI: 10.1146/Annurev.Physchem.55.091602.094402  0.362
2004 Cacciuto A, Auer S, Frenkel D. Onset of heterogeneous crystal nucleation in colloidal suspensions. Nature. 428: 404-6. PMID 15042084 DOI: 10.1038/Nature02397  0.669
2004 Schilling T, Frenkel D. Self-poisoning of crystal nuclei in hard-rod liquids. Physical Review Letters. 92: 085505. PMID 14995790 DOI: 10.1088/0953-8984/16/19/014  0.339
2004 WOJCIECHOWSKI K, FRENKEL D. TETRATIC PHASE IN THE PLANAR HARD SQUARE SYSTEM? Computational Methods in Science and Technology. 10: 235-255. DOI: 10.12921/Cmst.2004.10.02.235-255  0.345
2004 Ghiringhelli LM, Los JH, Meijer EJ, Fasolino A, Frenkel D. High-pressure diamondlike liquid carbon Physical Review B - Condensed Matter and Materials Physics. 69: 1001011-1001014. DOI: 10.1103/Physrevb.69.100101  0.572
2004 Miller MA, Frenkel D. Simulating colloids with Baxter s adhesive hard sphere model Journal of Physics: Condensed Matter. 16: S4901-S4912. DOI: 10.1088/0953-8984/16/42/008  0.372
2004 Blaak R, Auer S, Frenkel D, Löwen H. Homogeneous nucleation of colloidal melts under the influence of shearing fields Journal of Physics Condensed Matter. 16: S3873-S3884. DOI: 10.1088/0953-8984/16/38/007  0.639
2004 Hu W, Frenkel D. Effect of Metastable Liquid−Liquid Demixing on the Morphology of Nucleated Polymer Crystals Macromolecules. 37: 4336-4338. DOI: 10.1021/Ma049581T  0.349
2004 Bladon PB, Frenkel D. Free Energy and Structure of Dislocation Cores in Two-Dimensional Crystals† The Journal of Physical Chemistry B. 108: 6707-6718. DOI: 10.1021/Jp0369544  0.31
2004 Inda MA, Frenkel D. Multiple Histogram Method and Static Monte Carlo Sampling Macromolecular Theory and Simulations. 13: 36-43. DOI: 10.1002/Mats.200350040  0.321
2003 Coluzza I, Muller HG, Frenkel D. Designing refoldable model molecules. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 68: 046703. PMID 14683075 DOI: 10.1103/Physreve.68.046703  0.318
2003 Auer S, Frenkel D. Line tension controls wall-induced crystal nucleation in hard-sphere colloids. Physical Review Letters. 91: 015703. PMID 12906553 DOI: 10.1103/Physrevlett.91.015703  0.337
2003 Pronk S, Frenkel D. Large difference in the elastic properties of fcc and hcp hard-sphere crystals. Physical Review Letters. 90: 255501. PMID 12857141 DOI: 10.1103/Physrevlett.90.255501  0.377
2003 Capuani F, Frenkel D, Lowe CP. Velocity fluctuations and dispersion in a simple porous medium. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 67: 056306. PMID 12786271 DOI: 10.1103/Physreve.67.056306  0.315
2003 Sear RP, Frenkel D. Continuous freezing in three dimensions. Physical Review Letters. 90: 195701. PMID 12785957 DOI: 10.1103/Physrevlett.90.195701  0.389
2003 Miller MA, Frenkel D. Competition of percolation and phase separation in a fluid of adhesive hard spheres. Physical Review Letters. 90: 135702. PMID 12689308 DOI: 10.1103/Physrevlett.90.135702  0.439
2003 Auer S, Poon WC, Frenkel D. Phase behavior and crystallization kinetics of poly-12-hydroxystearic-coated polymethylmethacrylate colloids. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 67: 020401. PMID 12636644 DOI: 10.1103/Physreve.67.020401  0.349
2003 Cacciuto A, Auer S, Frenkel D. Solid-liquid interfacial free energy of small colloidal hard-sphere crystals Journal of Chemical Physics. 119: 7467-7470. DOI: 10.1063/1.1607307  0.68
2003 Hu W, Frenkel D, Mathot VBF. Lattice-model study of the thermodynamic interplay of polymer crystallization and liquid–liquid demixing The Journal of Chemical Physics. 118: 10343-10348. DOI: 10.1063/1.1572462  0.372
2003 Kern N, Frenkel D. Fluid–fluid coexistence in colloidal systems with short-ranged strongly directional attraction The Journal of Chemical Physics. 118: 9882-9889. DOI: 10.1063/1.1569473  0.43
2003 Das C, Frenkel D. Numerical calculation of the melting phase diagram of low molecular-weight polyethylene The Journal of Chemical Physics. 118: 9433-9440. DOI: 10.1063/1.1568934  0.383
2003 Combe N, Frenkel D. Phase behavior of a lattice protein model The Journal of Chemical Physics. 118: 9015-9022. DOI: 10.1063/1.1567256  0.422
2003 Hu W, Frenkel D, Mathot VBF. Free energy barrier to melting of single-chain polymer crystallite The Journal of Chemical Physics. 118: 3455-3457. DOI: 10.1063/1.1553980  0.326
2003 Anwar J, Frenkel D, Noro MG. Calculation of the melting point of NaCl by molecular simulation The Journal of Chemical Physics. 118: 728-735. DOI: 10.1063/1.1522375  0.395
2003 Hu W, Frenkel D, Mathot VBF. Intramolecular Nucleation Model for Polymer Crystallization Macromolecules. 36: 8178-8183. DOI: 10.1021/Ma0344285  0.343
2003 Hu W, Frenkel D, Mathot VBF. Sectorization of a Lamellar Polymer Crystal Studied by Dynamic Monte Carlo Simulations Macromolecules. 36: 549-552. DOI: 10.1021/Ma025853L  0.351
2003 Hu W, Mathot VBF, Frenkel D. Phase Transitions of Bulk Statistical Copolymers Studied by Dynamic Monte Carlo Simulations Macromolecules. 36: 2165-2175. DOI: 10.1021/Ma0213854  0.396
2002 Frenkel D, Schilling T. Smectic filaments in colloidal suspensions of rods. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 66: 041606. PMID 12443215 DOI: 10.1103/Physreve.66.041606  0.377
2002 Auer S, Frenkel D. Crystallization of weakly charged colloidal spheres: a numerical study Journal of Physics: Condensed Matter. 14: 7667-7680. DOI: 10.1088/0953-8984/14/33/308  0.376
2002 Bates MA, Noro MG, Frenkel D. Computer simulation of the phase behavior of a model membrane protein: Annexin V The Journal of Chemical Physics. 116: 7217-7224. DOI: 10.1063/1.1463423  0.39
2002 Hu W, Frenkel D, Mathot VBF. Simulation of Shish-Kebab Crystallite Induced by a Single Prealigned Macromolecule Macromolecules. 35: 7172-7174. DOI: 10.1021/Ma0255581  0.312
2002 Noro MG, Bates MA, Brisson A, Frenkel D. Modeling the Phase Behavior of the Membrane Binding Protein Annexin V Langmuir. 18: 2988-2992. DOI: 10.1021/La0156356  0.384
2002 Frenkel D. Soft condensed matter Physica a: Statistical Mechanics and Its Applications. 313: 1-31. DOI: 10.1016/S0378-4371(02)01032-4  0.393
2001 Horbach J, Frenkel D. Lattice-Boltzmann method for the simulation of transport phenomena in charged colloids. Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics. 64: 061507. PMID 11736191 DOI: 10.1103/Physreve.64.061507  0.329
2001 Auer S, Frenkel D. Suppression of crystal nucleation in polydisperse colloids due to increase of the surface free energy. Nature. 413: 711-3. PMID 11607025 DOI: 10.1038/35099513  0.382
2001 Auer S, Frenkel D. Prediction of absolute crystal-nucleation rate in hard-sphere colloids. Nature. 409: 1020-3. PMID 11234006 DOI: 10.1038/35059035  0.347
2001 Pagonabarraga I, Frenkel D. Dissipative particle dynamics for interacting systems The Journal of Chemical Physics. 115: 5015-5026. DOI: 10.1063/1.1396848  0.598
2001 Noro MG, Frenkel D. Phase behavior of a simple model for membrane proteins The Journal of Chemical Physics. 114: 2477-2483. DOI: 10.1063/1.1338504  0.365
2001 Pronk S, Frenkel D. Point Defects in Hard-Sphere Crystals† The Journal of Physical Chemistry B. 105: 6722-6727. DOI: 10.1021/Jp010779E  0.337
2000 Bates MA, Frenkel D. Phase behavior of model mixtures of colloidal disks and polymers Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 62: 5225-9. PMID 11089084 DOI: 10.1103/Physreve.62.5225  0.354
2000 Dogic Z, Frenkel D, Fraden S. Enhanced stability of layered phases in parallel hard spherocylinders due to addition of hard spheres Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 62: 3925-33. PMID 11088913 DOI: 10.1103/Physreve.62.3925  0.388
2000 Bates MA, Frenkel D. Influence of vacancies on the melting transition of hard disks in two dimensions Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 61: 5223-7. PMID 11031569 DOI: 10.1103/Physreve.61.5223  0.407
2000 Pagonabarraga I, Frenkel D. Non-Ideal DPD Fluids Molecular Simulation. 25: 167-175. DOI: 10.1080/08927020008044122  0.599
2000 Bates MA, Frenkel D. Phase behavior of two-dimensional hard rod fluids The Journal of Chemical Physics. 112: 10034-10041. DOI: 10.1063/1.481637  0.427
2000 Polson JM, Trizac E, Pronk S, Frenkel D. Finite-size corrections to the free energies of crystalline solids The Journal of Chemical Physics. 112: 5339-5342. DOI: 10.1063/1.481102  0.58
2000 Noro MG, Frenkel D. Extended corresponding-states behavior for particles with variable range attractions The Journal of Chemical Physics. 113: 2941-2944. DOI: 10.1063/1.1288684  0.303
2000 Frenkel D. Metastability and Nucleation Europhysics News. 31: 11-11. DOI: 10.1051/Epn:2000404  0.326
2000 Frenkel D. Perspective on “The effect of shape on the interaction of colloidal particles” Theoretical Chemistry Accounts. 103: 212-213. DOI: 10.1007/978-3-662-10421-7_13  0.325
1999 Noro MG, Kern N, Frenkel D. The role of long-range forces in the phase behavior of colloids and proteins Europhysics Letters (Epl). 48: 332-338. DOI: 10.1209/Epl/I1999-00485-9  0.399
1999 Pagonabarraga I, Hagen MHJ, Lowe CP, Frenkel D. Short-time dynamics of colloidal suspensions in confined geometries Physical Review E. 59: 4458-4469. DOI: 10.1103/Physreve.59.4458  0.59
1999 CONSTA S, VLUGT TJH, HOETH JW, SMIT B, FRENKEL D. Recoil growth algorithm for chain molecules with continuous interactions Molecular Physics. 97: 1243-1254. DOI: 10.1080/00268979909482926  0.63
1999 Polson JM, Frenkel D. Numerical prediction of the melting curve ofn-octane The Journal of Chemical Physics. 111: 1501-1510. DOI: 10.1063/1.479409  0.366
1999 Rein ten Wolde P, Oxtoby DW, Frenkel D. Chain formation in homogeneous gas–liquid nucleation of polar fluids The Journal of Chemical Physics. 111: 4762-4773. DOI: 10.1063/1.479239  0.324
1999 Blaak R, Frenkel D, Mulder BM. Do cylinders exhibit a cubatic phase? The Journal of Chemical Physics. 110: 11652-11659. DOI: 10.1063/1.479104  0.789
1999 Blaak R, Frenkel D, Mulder BM. Do cylinders exhibit a cubatic phase? Journal of Chemical Physics. 110: 11652-11659. DOI: 10.1063/1.479104  0.802
1999 Doye JPK, Frenkel D. The mechanism of thickness selection in the Sadler-Gilmer model of polymer crystallization The Journal of Chemical Physics. 110: 7073-7086. DOI: 10.1063/1.478613  0.307
1999 Bates MA, Frenkel D. Nematic–isotropic transition in polydisperse systems of infinitely thin hard platelets The Journal of Chemical Physics. 110: 6553-6559. DOI: 10.1063/1.478558  0.386
1999 Zhang J, Blaak R, Trizac E, Cuesta JA, Frenkel D. Optimal packing of polydisperse hard-sphere fluids The Journal of Chemical Physics. 110: 5318-5324. DOI: 10.1063/1.478426  0.738
1999 Pronk S, Frenkel D. Can stacking faults in hard-sphere crystals anneal out spontaneously? The Journal of Chemical Physics. 110: 4589-4592. DOI: 10.1063/1.478339  0.408
1999 Doye JPK, Frenkel D. Kinetic Monte Carlo simulations of the growth of polymer crystals The Journal of Chemical Physics. 110: 2692-2702. DOI: 10.1063/1.477992  0.346
1999 Consta S, Wilding NB, Frenkel D, Alexandrowicz Z. Recoil growth: An efficient simulation method for multi-polymer systems The Journal of Chemical Physics. 110: 3220-3228. DOI: 10.1063/1.477844  0.311
1999 ten Wolde PR, Ruiz-Montero MJ, Frenkel D. Numerical calculation of the rate of homogeneous gas–liquid nucleation in a Lennard-Jones system The Journal of Chemical Physics. 110: 1591-1599. DOI: 10.1063/1.477799  0.368
1999 Rein ten Wolde P, Frenkel D. Homogeneous nucleation and the Ostwald step rule Physical Chemistry Chemical Physics. 1: 2191-2196. DOI: 10.1039/A809346F  0.372
1999 Hagen M, Frenkel D, Lowe C. Rotational diffusion in dense suspensions Physica a: Statistical Mechanics and Its Applications. 272: 376-391. DOI: 10.1016/S0378-4371(99)00283-6  0.306
1999 Frenkel D. Entropy-driven phase transitions Physica a: Statistical Mechanics and Its Applications. 263: 26-38. DOI: 10.1016/S0378-4371(98)00501-9  0.406
1999 ten Wolde PR, Frenkel D. Enhanced protein crystallization around the metastable critical point Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta). 101: 205-208. DOI: 10.1007/S002140050430  0.381
1998 Pagonabarraga I, Hagen MHJ, Frenkel D. Self-consistent dissipative particle dynamics algorithm Europhysics Letters (Epl). 42: 377-382. DOI: 10.1209/Epl/I1998-00258-6  0.572
1998 Rein ten Wolde P, Oxtoby DW, Frenkel D. Coil-Globule Transition in Gas-Liquid Nucleation of Polar Fluids Physical Review Letters. 81: 3695-3698. DOI: 10.1103/Physrevlett.81.3695  0.352
1998 Doye JPK, Frenkel D. Mechanism of Thickness Determination in Polymer Crystals Physical Review Letters. 81: 2160-2163. DOI: 10.1103/Physrevlett.81.2160  0.337
1998 Pagonabarraga I, Hagen MHJ, Lowe CP, Frenkel D. Algebraic decay of velocity fluctuations near a wall Physical Review E. 58: 7288-7295. DOI: 10.1103/Physreve.58.7288  0.59
1998 Bates MA, Frenkel D. Infinitely thin disks exhibit a first order nematic-columnar phase transition Physical Review E. 57: 4824-4826. DOI: 10.1103/Physreve.57.4824  0.401
1998 ten Wolde PR, Frenkel D. Numerical study of gas–liquid nucleation in partially miscible binary mixtures The Journal of Chemical Physics. 109: 9919-9927. DOI: 10.1063/1.477682  0.386
1998 Doye JPK, Frenkel D. Crystallization of a polymer on a surface The Journal of Chemical Physics. 109: 10033-10041. DOI: 10.1063/1.477672  0.329
1998 ten Wolde PR, Frenkel D. Computer simulation study of gas–liquid nucleation in a Lennard-Jones system The Journal of Chemical Physics. 109: 9901-9918. DOI: 10.1063/1.477658  0.348
1998 Bates MA, Frenkel D. Influence of polydispersity on the phase behavior of colloidal liquid crystals: A Monte Carlo simulation study The Journal of Chemical Physics. 109: 6193-6199. DOI: 10.1063/1.477248  0.428
1998 Polson JM, Frenkel D. Calculation of solid-fluid phase equilibria for systems of chain molecules The Journal of Chemical Physics. 109: 318-328. DOI: 10.1063/1.476566  0.405
1998 Hagen MHJ, Frenkel D, Lowe CP. Non-Fickian diffusion in colloidal glasses The Journal of Chemical Physics. 109: 275-280. DOI: 10.1063/1.476562  0.305
1998 Doye JPK, Sear RP, Frenkel D. The effect of chain stiffness on the phase behaviour of isolated homopolymers The Journal of Chemical Physics. 108: 2134-2142. DOI: 10.1063/1.475592  0.378
1997 ten Wolde PR, Frenkel D. Enhancement of protein crystal nucleation by critical density fluctuations. Science (New York, N.Y.). 277: 1975-8. PMID 9302288 DOI: 10.1126/Science.277.5334.1975  0.367
1997 Lowe CP, van Roij R, Frenkel D. Comment on ``Novel Monte Carlo Approach to the Dynamics of Fluids: Single-Particle Diffusion, Correlation Functions, and Phase Ordering of Binary Fluids'' Physical Review Letters. 79: 1168-1168. DOI: 10.1103/Physrevlett.79.1168  0.371
1997 Hagen MHJ, Pagonabarraga I, Lowe CP, Frenkel D. Algebraic Decay of Velocity Fluctuations in a Confined Fluid Physical Review Letters. 78: 3785-3788. DOI: 10.1103/Physrevlett.78.3785  0.575
1997 Polson JM, Frenkel D. First-order nematic-smectic phase transition for hard spherocylinders in the limit of infinite aspect ratio Physical Review E. 56: R6260-R6263. DOI: 10.1103/Physreve.56.R6260  0.416
1997 Sear RP, Frenkel D. Phase behavior of colloid plus polydisperse polymer mixtures Physical Review E. 55: 1677-1681. DOI: 10.1103/Physreve.55.1677  0.33
1997 Silvestrelli PL, Alavi A, Parrinello M, Frenkel D. Structural, dynamical, electronic, and bonding properties of laser-heated silicon: Anab initiomolecular-dynamics study Physical Review B. 56: 3806-3812. DOI: 10.1103/Physrevb.56.3806  0.323
1997 Bolhuis P, Frenkel D. Isostructural solid - solid transitions in systems with a repulsive `shoulder' potential Journal of Physics: Condensed Matter. 9: 381-387. DOI: 10.1088/0953-8984/9/2/006  0.715
1997 Frenkel D, Smit B, Ratner MA. Understanding Molecular Simulation: From Algorithms to Applications Physics Today. 50: 66-66. DOI: 10.1063/1.881812  0.401
1997 Frenkel D, Smit B, Tobochnik J, McKay SR, Christian W. Understanding Molecular Simulation Computers in Physics. 11: 351. DOI: 10.1063/1.4822570  0.491
1997 Bolhuis PG, Stroobants A, Frenkel D, Lekkerkerker HNW. Numerical study of the phase behavior of rodlike colloids with attractive interactions Journal of Chemical Physics. 107: 1551-1564. DOI: 10.1063/1.474508  0.734
1997 Camp PJ, Allen MP, Bolhuis PG, Frenkel D. Demixing in hard ellipsoid rod-plate mixtures Journal of Chemical Physics. 106: 9270-9275. DOI: 10.1063/1.474012  0.725
1997 Bolhuis P, Frenkel D. Tracing the phase boundaries of hard spherocylinders The Journal of Chemical Physics. 106: 666-687. DOI: 10.1063/1.473404  0.695
1997 Frenkel D, Smit B. Simulation of phase coexistence for complex molecules Computers in Physics. 11: 246. DOI: 10.1063/1.168607  0.526
1997 Bolhuis PG, Frenkel D, Mau S, Huse DA. Entropy difference between crystal phases Nature. 388: 235-236. DOI: 10.1038/40779  0.702
1997 Bolhuis PG, Frenkel D. Microscopic and mesoscopic simulation of entropic micelles Physica a: Statistical Mechanics and Its Applications. 244: 45-58. DOI: 10.1016/S0378-4371(97)00240-9  0.705
1996 Silvestrelli PL, Alavi A, Parrinello M, Frenkel D. Ab Initio Molecular Dynamics Simulation Of Laser Melting Of Silicon Physical Review Letters. 77: 3149-3152. PMID 10062146 DOI: 10.1103/Physrevlett.77.3149  0.349
1996 Lowe CP, Frenkel D. Short-time dynamics of colloidal suspensions Physical Review E. 54: 2704-2713. PMID 9965384 DOI: 10.1103/Physreve.54.2704  0.326
1996 Frenkel D, Hansen J. Understanding liquids: a computer game? Physics World. 9: 35-42. DOI: 10.1088/2058-7058/9/4/24  0.614
1996 Biben T, Bladon P, Frenkel D. Depletion effects in binary hard-sphere fluids Journal of Physics: Condensed Matter. 8: 10799-10821. DOI: 10.1088/0953-8984/8/50/008  0.424
1996 Bladon P, Frenkel D. Simulating polymer liquid crystals Journal of Physics: Condensed Matter. 8: 9445-9449. DOI: 10.1088/0953-8984/8/47/043  0.412
1996 Mooij GCAM, Frenkel D. A Systematic Optimization Scheme for Configurational Bias Monte Carlo Molecular Simulation. 17: 41-55. DOI: 10.1080/08927029608024093  0.318
1996 Frenkel D, Bladon P, Bolhuis P, Hagen M. Liquid-Like Behavior in Solids Molecular Simulation. 16: 127-137. DOI: 10.1080/08927029608024067  0.726
1996 Smit B, Esselink K, Frenkel D. Solid-solid and liquid-solid phase equilibria for the restricted primitive model Molecular Physics. 87: 159-166. DOI: 10.1080/00268979600100081  0.558
1996 Sear RP, Frenkel D. Phase separation in mixtures of a rodlike colloid and two or more rodlike polymers The Journal of Chemical Physics. 105: 10632-10636. DOI: 10.1063/1.472949  0.332
1996 Rein ten Wolde P, Ruiz‐Montero MJ, Frenkel D. Numerical calculation of the rate of crystal nucleation in a Lennard‐Jones system at moderate undercooling The Journal of Chemical Physics. 104: 9932-9947. DOI: 10.1063/1.471721  0.392
1996 Lowe CP, Frenkel D, Masters AJ. Response to ‘‘Comment on ‘Long‐time tails in angular momentum correlations’ ’’ [J. Chem. Phys.104, 7363 (1996)] The Journal of Chemical Physics. 104: 7364-7365. DOI: 10.1063/1.471403  0.321
1996 ten Wolde P, Ruiz-Montero MJ, Frenkel D. Simulation of homogeneous crystal nucleation close to coexistence Faraday Discussions. 104: 93. DOI: 10.1039/Fd9960400093  0.36
1996 Frenkel D, Bladon P, Bolhuis P, Hagen M. Liquid-like behavior in colloidal crystals Physica B: Condensed Matter. 228: 33-39. DOI: 10.1016/S0921-4526(96)00332-8  0.729
1995 Wolde PRt, Ruiz-Montero MJ, Frenkel D. Numerical evidence for bcc ordering at the surface of a critical fcc nucleus Physical Review Letters. 75: 2714-2717. PMID 10059386 DOI: 10.1103/Physrevlett.75.2714  0.348
1995 Bladon P, Frenkel D. Dislocation unbinding in dense two-dimensional crystals. Physical Review Letters. 74: 2519-2522. PMID 10057948 DOI: 10.1103/Physrevlett.74.2519  0.433
1995 Dijkstra M, Frenkel D. Simulation study of the isotropic-to-nematic transitions of semiflexible polymers. Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 51: 5891-5898. PMID 9963327 DOI: 10.1103/Physreve.51.5891  0.672
1995 Van Roij R, Bolhuis P, Mulder B, Frenkel D. Transverse interlayer order in lyotropic smectic liquid crystals Physical Review E. 52: R1277-R1280. DOI: 10.1103/Physreve.52.R1277  0.74
1995 Hoef MAvd, Frenkel D. Computer simulations of long-time tails: what's new? Transport Theory and Statistical Physics. 24: 1227-1247. DOI: 10.1080/00411459508203951  0.342
1995 Lowe CP, Frenkel D, Masters AJ. Long‐time tails in angular momentum correlations The Journal of Chemical Physics. 103: 1582-1587. DOI: 10.1063/1.469780  0.32
1995 Lowe C, Frenkel D. The super long-time decay of velocity fluctuations in a two-dimensional fluid Physica a: Statistical Mechanics and Its Applications. 220: 251-260. DOI: 10.1016/0378-4371(95)00208-O  0.319
1995 Meijer EJ, Frenkel D. Computer simulation of colloid-polymer mixtures Physica a: Statistical Mechanics and Its Applications. 213: 130-137. DOI: 10.1016/0378-4371(94)00154-L  0.565
1994 Dijkstra M, Frenkel D. Evidence for entropy-driven demixing in hard-core fluids. Physical Review Letters. 72: 298-300. PMID 10056109 DOI: 10.1103/Physrevlett.72.298  0.635
1994 Bolhuis P, Frenkel D. Prediction of an expanded-to-condensed transition in colloidal crystals. Physical Review Letters. 72: 2211-2214. PMID 10055817 DOI: 10.1103/Physrevlett.72.2211  0.42
1994 Bolhuis P, Hagen M, Frenkel D. Isostructural solid-solid transition in crystalline systems with short-ranged interaction Physical Review E. 50: 4880-4890. PMID 9962569 DOI: 10.1103/Physreve.50.4880  0.418
1994 Dijkstra M, Frenkel D. Simulation study of a two-dimensional system of semiflexible polymers. Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 50: 349-357. PMID 9961974 DOI: 10.1103/Physreve.50.349  0.663
1994 Mackie AD, Panagiotopoulos AZ, Frenkel D, Kumar SK. Constant-Pressure Monte Carlo Simulations for Lattice Models Europhysics Letters (Epl). 27: 549-554. DOI: 10.1209/0295-5075/27/7/010  0.361
1994 Frenkel D. The simulation of entropic phase transitions Journal of Physics: Condensed Matter. 6: A71-A78. DOI: 10.1088/0953-8984/6/23A/008  0.404
1994 Dijkstra M, Frenkel D, Hansen J. Phase separation in binary hard‐core mixtures The Journal of Chemical Physics. 101: 3179-3189. DOI: 10.1063/1.468468  0.749
1994 Bolhuis P, Frenkel D. Numerical study of the phase diagram of a mixture of spherical and rodlike colloids The Journal of Chemical Physics. 101: 9869-9875. DOI: 10.1063/1.467953  0.74
1994 Hagen MHJ, Frenkel D. Determination of phase diagrams for the hard‐core attractive Yukawa system The Journal of Chemical Physics. 101: 4093-4097. DOI: 10.1063/1.467526  0.424
1994 Meijer EJ, Frenkel D. Colloids dispersed in polymer solutions. A computer simulation study The Journal of Chemical Physics. 100: 6873-6887. DOI: 10.1063/1.467003  0.581
1994 Frenkel D. Simulating mesoscopic order Computational Materials Science. 2: 127-130. DOI: 10.1016/0927-0256(94)90054-X  0.335
1993 Gerits M, Ernst MH, Frenkel D. Lattice-gas automata with attractive and repulsive interactions. Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 48: 988-999. PMID 9960682 DOI: 10.1103/Physreve.48.988  0.339
1993 Naitoh T, Ernst MH, van der Hoef MA, Frenkel D. Velocity correlations in a one-dimensional lattice gas: Theory and simulations. Physical Review. E, Statistical Physics, Plasmas, Fluids, and Related Interdisciplinary Topics. 47: 4098-4103. PMID 9960485 DOI: 10.1103/Physreve.47.4098  0.34
1993 Eldridge M, Madden P, Frenkel D. A computer simulation investigation into the stability of theAB2superlattice in a binary hard sphere system Molecular Physics. 80: 987-995. DOI: 10.1080/00268979300102811  0.419
1993 Lynden-Bell RM, Van Duijneveldt JS, Frenkel D. Free energy changes on freezing and melting ductile metals Molecular Physics. 80: 801-814. DOI: 10.1080/00268979300102661  0.403
1993 Eldridge M, Madden P, Frenkel D. The stability of the AB 13 crystal in a binary hard sphere system Molecular Physics. 79: 105-120. DOI: 10.1080/00268979300101101  0.392
1993 Hagen MHJ, Meijer EJ, Mooij GCAM, Frenkel D, Lekkerkerker HNW. Does C60 have a liquid phase? Nature. 365: 425-426. DOI: 10.1038/365425A0  0.353
1993 Eldridge MD, Madden PA, Frenkel D. Entropy-driven formation of a superlattice in a hard-sphere binary mixture Nature. 365: 35-37. DOI: 10.1038/365035A0  0.405
1993 Dijkstra M, Frenkel D, Lekkerkerker HNW. Confinement free energy of semiflexible polymers Physica a: Statistical Mechanics and Its Applications. 193: 374-393. DOI: 10.1016/0378-4371(93)90482-J  0.619
1993 Wojciechowski K, Brańka A, Frenkel D. Monte Carlo simulations of a two-dimensional hard dimer system Physica a: Statistical Mechanics and Its Applications. 196: 519-545. DOI: 10.1016/0378-4371(93)90033-Z  0.418
1993 Frenkel D. Order through disorder: Entropy-driven phase transitions Lecture Notes in Physics. 415: 137-148. DOI: 10.1007/3540563962_68  0.351
1993 Allen MP, Evans G, Frenkel D, Mulder B. Hard convex body fluids Advances in Chemical Physics. 86: 1-166. DOI: 10.1002/9780470141458.Ch1  0.687
1992 Smit B, Mooij GC, Frenkel D. Comment on "Determination of the chemical potential of polymeric systems from Monte Carlo simulations" Physical Review Letters. 68: 3657. PMID 10045762 DOI: 10.1103/Physrevlett.68.3657  0.491
1992 Frenkel D, Louis AA. Phase separation in binary hard-core mixtures: An exact result. Physical Review Letters. 68: 3363-3365. PMID 10045683 DOI: 10.1103/Physrevlett.68.3363  0.368
1992 Alavi A, Frenkel D. Anomalous diffusion in the nematic phase of thin disks. Physical Review A. 45. PMID 9907728 DOI: 10.1103/Physreva.45.R5355  0.394
1992 Veerman JAC, Frenkel D. Phase behavior of disklike hard-core mesogens Physical Review A. 45: 5632-5648. PMID 9907661 DOI: 10.1103/Physreva.45.5632  0.365
1992 Van Der Hoef MA, Dijkstra M, Frenkel D. Velocity autocorrelation function in a four-dimensional lattice gas Epl. 17: 39-43. DOI: 10.1209/0295-5075/17/1/008  0.629
1992 Siepmann JI, McDonald IR, Frenkel D. Finite-size corrections to the chemical potential Journal of Physics: Condenced Matter. 4: 679-691. DOI: 10.1088/0953-8984/4/3/009  0.35
1992 Mooij GCAM, Frenkel D, Smit B. Direct simulation of phase equilibria of chain molecules Journal of Physics: Condensed Matter. 4: L255-L259. DOI: 10.1088/0953-8984/4/16/001  0.559
1992 Frenkel D, Mooij GCAM, Smit B. Novel scheme to study structural and thermal properties of continuously deformable molecules Journal of Physics: Condensed Matter. 4: 3053-3076. DOI: 10.1088/0953-8984/4/12/006  0.501
1992 Frenkel D, Smit B. Unexpected length dependence of the solubility of chain molecules Molecular Physics. 75: 983-988. DOI: 10.1080/00268979200100761  0.477
1992 Siepmann JI, Frenkel D. Configurational bias Monte Carlo: a new sampling scheme for flexible chains Molecular Physics. 75: 59-70. DOI: 10.1080/00268979200100061  0.336
1992 Alavi A, Frenkel D. Grand‐canonical simulations of solvated ideal fermions. Evidence for phase separation The Journal of Chemical Physics. 97: 9249-9257. DOI: 10.1063/1.463300  0.409
1992 van Duijneveldt JS, Frenkel D. Computer simulation study of free energy barriers in crystal nucleation The Journal of Chemical Physics. 96: 4655-4668. DOI: 10.1063/1.462802  0.418
1992 Ladd AJC, Frenkel D. Computer simulation studies of static and dynamical scaling in dilute solutions of excluded-volume polymers Macromolecules. 25: 3435-3438. DOI: 10.1021/Ma00039A019  0.303
1992 Tjipto-Margo B, Evans GT, Allen MP, Frenkel D. Elastic constants of hard and soft nematic liquid crystals The Journal of Physical Chemistry. 96: 3942-3948. DOI: 10.1021/J100189A007  0.388
1991 Meijer EJ, Frenkel D. Computer simulation of polymer-induced clustering of colloids. Physical Review Letters. 67: 1110-1113. PMID 10045078 DOI: 10.1103/Physrevlett.67.1110  0.551
1991 van der Hoef MA, Frenkel D, Ladd AJ. Self-diffusion of colloidal particles in a two-dimensional suspension: Are deviations from Fick's law experimentally observable? Physical Review Letters. 67: 3459-3462. PMID 10044739 DOI: 10.1103/Physrevlett.67.3459  0.343
1991 Hoef MAvd, Frenkel D. Evidence for faster-than-t-1 decay of the velocity autocorrelation function in a 2D fluid. Physical Review Letters. 66: 1591-1594. PMID 10043249 DOI: 10.1103/Physrevlett.66.1591  0.315
1991 Veerman JAC, Frenkel D. Relative stability of columnar and crystalline phases in a system of parallel hard spherocylinders Physical Review A. 43: 4334-4343. PMID 9905536 DOI: 10.1103/Physreva.43.4334  0.394
1991 Hess S, Frenkel D, Allen M. On the anisotropy of diffusion in nematic liquid crystals: test of a modified affine transformation model via molecular dynamics Molecular Physics. 74: 765-774. DOI: 10.1080/00268979100102561  0.364
1991 Mooij G, Frenkel D. Novel scheme to compute chemical potentials of chain molecules on a lattice Molecular Physics. 74: 41-47. DOI: 10.1080/00268979100102041  0.321
1991 Smit B, Frenkel D. Vapour-liquid equilibria of the hard core Yukawa fluid Molecular Physics. 74: 35-39. DOI: 10.1080/00268979100102031  0.502
1991 Kranendonk W, Frenkel D. Thermodynamic properties of binary hard sphere mixtures Molecular Physics. 72: 715-733. DOI: 10.1080/00268979100100521  0.403
1991 Kranendonk W, Frenkel D. Free energy calculations for solid solutions by computer simulations Molecular Physics. 72: 699-713. DOI: 10.1080/00268979100100511  0.309
1991 Kranendonk W, Frenkel D. Computer simulation of solid-liquid coexistence in binary hard sphere mixtures Molecular Physics. 72: 679-697. DOI: 10.1080/00268979100100501  0.38
1991 Smit B, Frenkel D. Vapor–liquid equilibria of the two‐dimensional Lennard‐Jones fluid(s) The Journal of Chemical Physics. 94: 5663-5668. DOI: 10.1063/1.460477  0.526
1991 Meijer EJ, Frenkel D. Melting line of Yukawa system by computer simulation The Journal of Chemical Physics. 94: 2269-2271. DOI: 10.1063/1.459898  0.567
1991 Frenkel D. Free-energy calculations Nato Asi Series. Series E, Applied Sciences. 205: 85-117. DOI: 10.1016/B978-012267351-1/50009-2  0.416
1991 Frenkel D. Simulation of sub-molecular and supra-molecular fluids Physica a-Statistical Mechanics and Its Applications. 176: 54-62. DOI: 10.1016/0378-4371(91)90432-C  0.398
1991 Van Der Hoef M, Frenkel D. Tagged particle diffusion in 3d lattice gas cellular automata Physica D: Nonlinear Phenomena. 47: 191-197. DOI: 10.1016/0167-2789(91)90289-L  0.318
1991 van der Gon A, Frenkel D, Frenken J, Smith R, Stoltze P. Calculation of ion scattering yields from simulated crystal surfaces: theory and application to melting and non-melting Al surfaces Surface Science. 256: 385-396. DOI: 10.1016/0039-6028(91)90881-R  0.322
1990 Talbot J, Kivelson D, Tarjus G, Allen MP, Evans GT, Frenkel D. Short-time correlations in liquids: Molecular-dynamics simulation of hard spheroids. Physical Review Letters. 65: 2828-2831. PMID 10042705 DOI: 10.1103/Physrevlett.65.2828  0.33
1990 Cuesta JA, Frenkel D. Monte Carlo simulation of two-dimensional hard ellipses Physical Review A. 42: 2126-2136. PMID 9904261 DOI: 10.1103/Physreva.42.2126  0.398
1990 Hoef MAvd, Frenkel D. Long-time tails of the velocity autocorrelation function in two- and three-dimensional lattice-gas cellular automata: A test of mode-coupling theory. Physical Review A. 41: 4277-4284. PMID 9903620 DOI: 10.1103/Physreva.41.4277  0.303
1990 Veerman JAC, Frenkel D. Phase diagram of a system of hard spherocylinders by computer simulation Physical Review A. 41: 3237-3244. PMID 9903479 DOI: 10.1103/Physreva.41.3237  0.355
1990 Frenkel D. From lattice gases to polymers Journal of Physics: Condensed Matter. 2: SA265-SA269. DOI: 10.1088/0953-8984/2/S/039  0.326
1990 Ladd AJC, Frenkel D. Dissipative hydrodynamic interactions via lattice‐gas cellular automata Physics of Fluids a: Fluid Dynamics. 2: 1921-1924. DOI: 10.1063/1.857667  0.343
1990 Meijer EJ, Frenkel D, LeSar RA, Ladd AJC. Location of melting point at 300 K of nitrogen by Monte Carlo simulation The Journal of Chemical Physics. 92: 7570-7575. DOI: 10.1063/1.458193  0.619
1990 Talbot J, Kivelson D, Allen MP, Evans GT, Frenkel D. Structure of the hard ellipsoid fluid The Journal of Chemical Physics. 92: 3048-3057. DOI: 10.1063/1.457902  0.337
1990 Pluis B, Frenkel D, van der Veen JF. Surface-induced melting and freezing II. A semi-empirical Landau-type model Surface Science. 239: 282-300. DOI: 10.1016/0039-6028(90)90231-V  0.305
1990 Naitoh T, Ernst MH, Hoef MAvd, Frenkel D. Effects of sound modes on the VACF in cellular automation fluids Lecture Notes in Physics. 398: 29-38. DOI: 10.1007/Bfb0022305  0.312
1989 Frenkel D, Ernst MH. Simulation of diffusion in a two-dimensional lattice-gas cellular automaton: A test of mode-coupling theory. Physical Review Letters. 63: 2165-2168. PMID 10040817 DOI: 10.1103/Physrevlett.63.2165  0.317
1989 Talbot J, Allen MP, Evans GT, Frenkel D, Kivelson D. Accuracy of Enskog theory for rotational versus translational motion: A molecular-dynamics study. Physical Review. A. 39: 4330-4332. PMID 9901777 DOI: 10.1103/Physreva.39.4330  0.332
1989 Vogelsang R, Hoheisel C, Sindzingre P, Ciccotti G, Frenkel D. Computation of partial enthalpies of various Lennard-Jones model mixtures by NPT molecular dynamics Journal of Physics: Condensed Matter. 1: 957-963. DOI: 10.1088/0953-8984/1/5/012  0.345
1989 Smit B, Frenkel D. An explicit expression for finite-size corrections to the chemical potential Journal of Physics: Condensed Matter. 1: 8659-8665. DOI: 10.1088/0953-8984/1/44/035  0.506
1989 Frenkel D. Invited Lecture. Columnar ordering as an excluded-volume effect Liquid Crystals. 5: 929-940. DOI: 10.1080/02678298908026399  0.451
1989 Smit B, Frenkel D. Calculation of the chemical potential in the Gibbs ensemble Molecular Physics. 68: 951-958. DOI: 10.1080/00268978900102651  0.528
1989 Smit B, Smedt Pd, Frenkel D. Computer simulations in the Gibbs ensemble Molecular Physics. 68: 931-950. DOI: 10.1080/00268978900102641  0.529
1989 Vega C, Frenkel D. Monte carlo study of rod-like molecules a test of perturbation theory for the kihara model Molecular Physics. 67: 633-650. DOI: 10.1080/00268978900101331  0.349
1989 Veerman J, Frenkel D. Computer simulation of crystal nucleation of parallel hard spherocylinders Physica a: Statistical Mechanics and Its Applications. 156: 599-612. DOI: 10.1016/0378-4371(89)90083-6  0.404
1989 Sindzingre P, Massobrio C, Ciccotti G, Frenkel D. Calculation of partial enthalpies of an argon-krypton mixture by NPT molecular dynamics Chemical Physics. 129: 213-224. DOI: 10.1016/0301-0104(89)80007-2  0.351
1989 Allen M, Frenkel D, Talbot J. Molecular dynamics simulation using hard particles Computer Physics Reports. 9: 301-353. DOI: 10.1016/0167-7977(89)90009-9  0.325
1988 Ladd AJ, Colvin ME, Frenkel D. Application of lattice-gas cellular automata to the Brownian motion of solids in suspension. Physical Review Letters. 60: 975-978. PMID 10037909 DOI: 10.1103/Physrevlett.60.975  0.368
1988 Frenkel D, Kil AJ, Doef BMvd, Zijlstra RJJ. Monte Carlo simulation of carrier number noise spectra in the integral quantum Hall regime Journal of Physics C: Solid State Physics. 21: L177-L183. DOI: 10.1088/0022-3719/21/7/004  0.31
1988 Warmerdam TW, Zijlstra RJJ, Frenkel D. Dynamics of the Frederiks transition in nematics consisting of disc-like molecules Thermal dependence of a bend viscosity coefficient Liquid Crystals. 3: 1105-1114. DOI: 10.1080/02678298808086565  0.361
1988 Warmerdam TW, Nolte RJM, Drenth W, Van Miltenburg JC, Frenkel D, Zijlstra RJJ. Discotic liquid crystals: Physical parameters of some 2,3,7,8,12,13-hexa(alkanoyloxy)truxenes. Observation of a re-entrant isotropic phase in a pure disc-like mesogen Liquid Crystals. 3: 1087-1104. DOI: 10.1080/02678298808086564  0.35
1988 Böttger A, Niessen L, Coelingh J, Frenkel D, Zijlstra RJJ. Dynamic light scattering near the isotropic-blue phase transition of cholesteryl-oleylcarbonate Liquid Crystals. 3: 337-345. DOI: 10.1080/02678298808086379  0.335
1988 Warmerdam T, Frenkel D, Zijlstra RJJ. Observation of a re-entrant isotropic phase in a pure disc-like liquid crystal Liquid Crystals. 3: 149-152. DOI: 10.1080/02678298808086360  0.355
1988 Kranendonk WGT, Frenkel D. Simulation of the adhesive-hard-sphere model Molecular Physics. 64: 403-424. DOI: 10.1080/00268978800100303  0.414
1988 Frenkel D, Lekkerkerker HNW, Stroobants A. Thermodynamic stability of a smectic phase in a system of hard rods Nature. 332: 822-823. DOI: 10.1038/332822A0  0.384
1988 Frenkel D. Structure of hard-core models for liquid crystals The Journal of Physical Chemistry. 92: 3280-3284. DOI: 10.1021/J100322A042  0.432
1987 Udink C, Frenkel D. Orientational order and solid-liquid coexistence in the two-dimensional Lennard-Jones system. Physical Review B. 35: 6933-6939. PMID 9940951 DOI: 10.1103/Physrevb.35.6933  0.389
1987 Stroobants A, Lekkerkerker HN, Frenkel D. Evidence for one-, two-, and three-dimensional order in a system of hard parallel spherocylinders. Physical Review. A. 36: 2929-2945. PMID 9899198 DOI: 10.1103/Physreva.36.2929  0.382
1987 Bottger A, Frenkel D, Van De Riet E, Zijlstra R. Diffusion of brownian particles in the isotropic phase of a nematic liquid crystal Liquid Crystals. 2: 539-547. DOI: 10.1080/02678298708086309  0.388
1987 Frenkel D. Onsager's spherocylinders revisited The Journal of Physical Chemistry. 91: 4912-4916. DOI: 10.1021/J100303A008  0.45
1987 Frenkel D. Computer simulation of hard-core models for liquid crystals Molecular Physics. 60: 1-20. DOI: 10.1016/0010-4655(87)90079-8  0.419
1987 Sindzingre P, Ciccotti G, Massobrio C, Frenkel D. Partial enthalpies and related quantities in mixtures from computer simulation Chemical Physics Letters. 136: 35-41. DOI: 10.1016/0009-2614(87)87294-9  0.348
1986 Stroobants A, Lekkerkerker HN, Frenkel D. Evidence for smectic order in a fluid of hard parallel spherocylinders. Physical Review Letters. 57: 1452-1455. PMID 10033453 DOI: 10.1103/Physrevlett.57.1452  0.425
1986 Frenkel D. Stability of the high-pressure body-centered-cubic phase of helium. Physical Review Letters. 56: 858-860. PMID 10033304 DOI: 10.1103/Physrevlett.56.858  0.343
1986 Frenkel D, Vos RJ, De Kruif CG, Vrij A. Structure factors of polydisperse systems of hard spheres: A comparison of Monte Carlo simulations and Percus-Yevick theory The Journal of Chemical Physics. 84: 4625-4630. DOI: 10.1063/1.449987  0.375
1985 Mulder BM, Frenkel D. The hard ellipsoid-of-revolution fluid ii. The y-expansion equation of state Molecular Physics. 55: 1193-1215. DOI: 10.1080/00268978500101981  0.742
1985 Frenkel D. Approximate relation between the melting of hard spheres and ellipsoidal platelets and needles Molecular Physics. 54: 145-148. DOI: 10.1080/00268978500100121  0.385
1985 Frenkel D, Mulder BM. The hard ellipsoid-of-revolution fluid i. Monte carlo simulations Molecular Physics. 55: 1171-1192. DOI: 10.1080/00268970110088992  0.751
1985 Frenkel D, Mulder BM, Mctague JP. Phase Diagram of Hard Ellipsoids of Revolution Molecular Crystals and Liquid Crystals. 123: 119-128. DOI: 10.1080/00268948508074770  0.805
1984 Frenkel D, Mulder BM, McTague JP. Phase diagram of a system of hard Ellipsoids Physical Review Letters. 52: 287-290. DOI: 10.1103/Physrevlett.52.287  0.803
1984 Eppenga R, Frenkel D. Monte Carlo study of the isotropic and nematic phases of infinitely thin hard platelets Molecular Physics. 52: 1303-1334. DOI: 10.1080/00268978400101951  0.398
1984 Frenkel D, Ladd AJC. New Monte Carlo method to compute the free energy of arbitrary solids. Application to the fcc and hcp phases of hard spheres The Journal of Chemical Physics. 81: 3188-3193. DOI: 10.1063/1.448024  0.393
1983 Frenkel D, Maguire J. Molecular dynamics study of the dynamical properties of an assembly of infinitely thin hard rods Molecular Physics. 49: 503-541. DOI: 10.1080/00268978300101331  0.336
1983 Allen MP, Frenkel D, Gignac W, McTague JP. A Monte Carlo simulation study of the two‐dimensional melting mechanism The Journal of Chemical Physics. 78: 4206-4222. DOI: 10.1063/1.445098  0.667
1982 Frenkel D, Eppenga R. Monte Carlo Study of the Isotropic-Nematic Transition in a Fluid of Thin Hard Disks Physical Review Letters. 49: 1089-1092. DOI: 10.1103/Physrevlett.49.1089  0.425
1980 Frenkel D, McTague JP. Computer Simulations of Freezing and Supercooled Liquids Annual Review of Physical Chemistry. 31: 491-521. DOI: 10.1146/Annurev.Pc.31.100180.002423  0.68
1980 Frenkel D, McTague JP. Molecular dynamics studies of orientational and collision‐induced light scattering in molecular fluids The Journal of Chemical Physics. 72: 2801-2818. DOI: 10.1063/1.439429  0.604
1979 Frenkel D, McTague JP. Evidence for an orientationally ordered two-dimensional fluid phase from molecular-dynamics calculations Physical Review Letters. 42: 1632-1635. DOI: 10.1103/PhysRevLett.42.1632  0.618
1979 Frenkel D, McTague JP. On the Raman spectrum of argon dimersa) The Journal of Chemical Physics. 70: 2695-2699. DOI: 10.1063/1.437855  0.506
1978 Van Der Peijl GJQ, Frenkel D, Van Der Elsken J. Experimental and calculated cross sections for pressure broadening of pure rotational Raman lines of HCl Chemical Physics Letters. 56: 602-607. DOI: 10.1016/0009-2614(78)89050-2  0.635
1977 Van Der Elsken J, Frenkel D. Rotational relaxation of solute molecules in dense noble gases and the relation with local anisotropy fluctuations Faraday Symposia of the Chemical Society. 11: 125-135. DOI: 10.1039/Fs9771100125  0.655
1977 Frenkel D, van der Elsken J. Density dependence of the pressure induced shift of HCl rotational lines perturbed by argon Chemical Physics Letters. 50: 116-119. DOI: 10.1016/0009-2614(77)80692-1  0.638
1976 Frenkel D, van der Elsken J. Molecular dynamics calculations on the time dependence of simple, anisotropic potentials in dense argon Chemical Physics Letters. 40: 14-18. DOI: 10.1016/0009-2614(76)80109-1  0.653
1976 Frenkel D, Gravesteyn DJ, van der Elsken J. Non-linear density dependence of rotational line-broadening of HCl in dense argon Chemical Physics Letters. 40: 9-13. DOI: 10.1016/0009-2614(76)80108-X  0.634
1972 Van Aalst RM, Van Der Elsken J, Frenkel D, Wegdam GH. Interpretation of dipole correlation functions in some liquid systems Faraday Symposia of the Chemical Society. 6: 94-105. DOI: 10.1039/Fs9720600094  0.667
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