LAMMPS-a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales AP Thompson, HM Aktulga, R Berger, DS Bolintineanu, WM Brown, ... Computer Physics Communications 271, 108171, 2022 | 3976 | 2022 |
Application of Ewald summations to long-range dispersion forces PJ in 't Veld, AE Ismail, GS Grest The Journal of chemical physics 127 (14), 144711, 2007 | 141 | 2007 |
Temperature-dependent elasticity of a semicrystalline interphase composed of freely rotating chains PJ in 't Veld, GC Rutledge Macromolecules 36 (19), 7358-7365, 2003 | 106 | 2003 |
Deformation mechanisms of thermoplastic elastomers: Stress-strain behavior and constitutive modeling H Cho, S Mayer, E Pöselt, M Susoff, PJ in 't Veld, GC Rutledge, MC Boyce Polymer 128, 87-99, 2017 | 87 | 2017 |
A molecular simulation study of cavity size distributions and diffusion in para and meta isomers XY Wang, PJ in 't Veld, Y Lu, BD Freeman, IC Sanchez Polymer 46 (21), 9155-9161, 2005 | 83 | 2005 |
Configurational properties and corresponding states in simple fluids and water IC Sanchez, TM Truskett, PJ in 't Veld The Journal of Physical Chemistry B 103 (24), 5106-5116, 1999 | 74 | 1999 |
Mesoscale hydrodynamics via stochastic rotation dynamics: Comparison with Lennard-Jones fluid MK Petersen, JB Lechman, SJ Plimpton, GS Grest, PJ in 't Veld, ... The Journal of chemical physics 132 (17), 174106, 2010 | 70 | 2010 |
Accurate and efficient methods for modeling colloidal mixtures in an explicit solvent using molecular dynamics PJ in 't Veld, SJ Plimpton, GS Grest Computer Physics Communications 179 (5), 320-329, 2008 | 70 | 2008 |
Simulation of the mechanical strength of a single collagen molecule PJ in 't Veld, MJ Stevens Biophysical journal 95 (1), 33-39, 2008 | 69 | 2008 |
Surface tension of normal and branched alkanes AE Ismail, M Tsige, PJ in 't Veld, GS Grest Molecular Physics 105 (23-24), 3155-3163, 2007 | 57 | 2007 |
Temperature-dependent thermal and elastic properties of the interlamellar phase of semicrystalline polyethylene by molecular simulation PJ in 't Veld, M Hütter, GC Rutledge Macromolecules 39 (1), 439-447, 2006 | 55 | 2006 |
Molecular Simulation of Thermoplastic Polyurethanes under Large Tensile Deformation S Zhu, N Lempesis, PJ in ‘t Veld, GC Rutledge Macromolecules 51 (5), 1850-1864, 2018 | 51 | 2018 |
Effect of short chain branching on the interlamellar structure of semicrystalline polyethylene V Kumar, CR Locker, PJ in’t Veld, GC Rutledge Macromolecules 50 (3), 1206-1214, 2017 | 43 | 2017 |
Liquid structure via cavity size distributions PJ in 't Veld, MT Stone, TM Truskett, IC Sanchez The Journal of Physical Chemistry B 104 (50), 12028-12034, 2000 | 42 | 2000 |
All-atomic and coarse-grained molecular dynamics investigation of deformation in semi-crystalline lamellar polyethylene PAT Olsson, PJ in ’t Veld, E Andreasson, E Bergvall, EP Jutemar, ... Polymer, 2018 | 39 | 2018 |
Atomistic simulation of the structure and mechanics of a semicrystalline polyether N Lempesis, PJ in ‘t Veld, GC Rutledge Macromolecules 49 (15), 5714-5726, 2016 | 37 | 2016 |
Atomistic simulation of a thermoplastic polyurethane and micromechanical modeling N Lempesis, PJ in ‘t Veld, GC Rutledge Macromolecules 50 (18), 7399-7409, 2017 | 36 | 2017 |
Polyethylene {201} crystal surface: interface stresses and thermodynamics M Hütter, PJ in 't Veld, GC Rutledge Polymer 47 (15), 5494-5504, 2006 | 34* | 2006 |
Engineering the Mechanics of Heterogeneous Soft Crystals H Cho, JC Weaver, E Pöselt, PJ in 't Veld, MC Boyce, GC Rutledge Advanced Functional Materials 26 (38), 6938–6949, 2016 | 31 | 2016 |
Monte Carlo simulation of interlamellar isotactic polypropylene VK Kuppa, PJ in 't Veld, GC Rutledge Macromolecules 40 (14), 5187-5195, 2007 | 27 | 2007 |