| COMPASS II: extended coverage for polymer and drug-like molecule databases H Sun, Z Jin, C Yang, RLC Akkermans, SH Robertson, NA Spenley, ... Journal of molecular modeling 22, 1-10, 2016 | 629 | 2016 |
| Monte Carlo methods in materials studio RLC Akkermans, NA Spenley, SH Robertson Molecular Simulation 39 (14-15), 1153-1164, 2013 | 291 | 2013 |
| A structure-based coarse-grained model for polymer melts RLC Akkermans, WJ Briels The Journal of Chemical Physics 114 (2), 1020-1031, 2001 | 151 | 2001 |
| Coarse-grained dynamics of one chain in a polymer melt RLC Akkermans, WJ Briels The Journal of Chemical Physics 113 (15), 6409-6422, 2000 | 130 | 2000 |
| Molecular dynamics of polymer growth RLC Akkermans, S Toxvaerd, WJ Briels The Journal of chemical physics 109 (7), 2929-2940, 1998 | 65 | 1998 |
| COMPASS III: Automated fitting workflows and extension to ionic liquids RLC Akkermans, NA Spenley, SH Robertson Molecular Simulation 47 (7), 540-551, 2021 | 63 | 2021 |
| Multiscale modelling of human hair RLC Akkermans, PB Warren Philosophical Transactions of the Royal Society of London. Series A …, 2004 | 62 | 2004 |
| Coarse-grained interactions in polymer melts: A variational approach RLC Akkermans, WJ Briels The Journal of Chemical Physics 115 (13), 6210-6219, 2001 | 50 | 2001 |
| Mesoscale model parameters from molecular cluster calculations RLC Akkermans The Journal of chemical physics 128 (24), 2008 | 30 | 2008 |
| On the equivalence of atomic and molecular pressure RLC Akkermans, G Ciccotti The Journal of Physical Chemistry B 108 (21), 6866-6869, 2004 | 24 | 2004 |
| Representation of coarse-grained potentials for polymer simulations WJ Briels, RLC Akkermans Molecular simulation 28 (1-2), 145-152, 2002 | 23 | 2002 |
| Multi-scale electrolyte transport simulations for lithium ion batteries F Hanke, N Modrow, RLC Akkermans, I Korotkin, FC Mocanu, VA Neufeld, ... Journal of The Electrochemical Society 167 (1), 013522, 2019 | 18 | 2019 |
| Solvation free energy of regular and azeotropic molecular mixtures RLC Akkermans The Journal of Physical Chemistry B 121 (7), 1675-1683, 2017 | 14 | 2017 |
| Molecular simulation of thermoset curing: application to 3D printing materials M Jenei, RLC Akkermans, S Robertson, JA Elliott Molecular Simulation 47 (7), 575-585, 2021 | 7 | 2021 |
| The Langevin equation for generalized coordinates RLC Akkermans New Algorithms for Macromolecular Simulation, 155-165, 2006 | 5 | 2006 |
| Multiscale Modeling of Human Skin R LC Akkermans, J T Wescott Current Nanoscience 7 (5), 736-742, 2011 | 4 | 2011 |
| Modeling and Simulating Material Microstructures F Hanke, J Wescott, S Schweizer, L Subramanian, K Skinner, ... US Patent App. 17/449,312, 2022 | | 2022 |
| Representative trajectory data supporting" Multiscale Electrolyte Transport Simulations for Lithium Ion Batteries" F Hanke, N Modrow, RLC Akkermans, I Korotkin, FC Mocanu, VA Neufeld, ... | | 2020 |
| Molecular dynamics of polymer melts-Simulation of growth and coarse-grained modeling. RLC Akkermans | | 2000 |
| MD simulations of polymer growth RLC Akkermans, WJ Briels | | 1997 |
Huai SunShanghai Jiao Tong UniversityVerified email at sjtu.edu.cn
