Molecular Simulation of Thermoplastic Polyurethanes under Large Tensile Deformation von Zhu, Shuze, Lempesis, Nikolaos, in ‘t Veld, Pieter J, Rutledge, Gregory C

Volltext

Closed-Form Coexistence Equation for Phase Separation of Polymeric Mixtures in Dissipative Particle Dynamics von van der Haven, Dingeman L. H, Köhler, Stephan, Schreiner, Eduard, in ’t Veld, Pieter J

Volltext

Simulation of the structure and mechanics of crystalline 4,4′-diphenylmethane diisocyanate (MDI) with n-butanediol (BDO) as chain extender von Lempesis, Nikolaos, in ‘t Veld, Pieter J., Rutledge, Gregory C.

Volltext

Implementing reactivity in molecular dynamics simulations with harmonic force fields von Winetrout, Jordan J., Kanhaiya, Krishan, Kemppainen, Joshua, in ‘t Veld, Pieter J., Sachdeva, Geeta, Pandey, Ravindra, Damirchi, Behzad, van Duin, Adri, Odegard, Gregory M., Heinz, Hendrik

Volltext

LAMMPS - a flexible simulation tool for particle-based materials modeling at the atomic, meso, and continuum scales von Thompson, Aidan P., Aktulga, H. Metin, Berger, Richard, Bolintineanu, Dan S., Brown, W. Michael, Crozier, Paul S., in 't Veld, Pieter J., Kohlmeyer, Axel, Moore, Stan G., Nguyen, Trung Dac, Shan, Ray, Stevens, Mark J., Tranchida, Julien, Trott, Christian, Plimpton, Steven J.

Volltext

Atomistic Simulation of a Thermoplastic Polyurethane and Micromechanical Modeling von Lempesis, Nikolaos, in ‘t Veld, Pieter J, Rutledge, Gregory C

Volltext

Effects of Coarse-Graining on Molecular Simulation of Craze Formation in Polymer Glass von Wang, Jiuling, in ’t Veld, Pieter J, Robbins, Mark O, Ge, Ting

Volltext

Molecular Simulation of Thermoplastic Polyurethanes under Large Compressive Deformation von Zhu, Shuze, Lempesis, Nikolaos, in ‘t Veld, Pieter J, Rutledge, Gregory C

Volltext

All-atomic and coarse-grained molecular dynamics investigation of deformation in semi-crystalline lamellar polyethylene von Olsson, Pär A.T., in ’t Veld, Pieter J., Andreasson, Eskil, Bergvall, Erik, Persson Jutemar, Elin, Petersson, Viktor, Rutledge, Gregory C., Kroon, Martin

Volltext

Atomistic Simulation of the Structure and Mechanics of a Semicrystalline Polyether von Lempesis, Nikolaos, in ‘t Veld, Pieter J, Rutledge, Gregory C

Volltext

Collaborative Assessment of Molecular Geometries and Energies from the Open Force Field von D’Amore, Lorenzo, Hahn, David F., Dotson, David L., Horton, Joshua T., Anwar, Jamshed, Craig, Ian, Fox, Thomas, Gobbi, Alberto, Lakkaraju, Sirish Kaushik, Lucas, Xavier, Meier, Katharina, Mobley, David L., Narayanan, Arjun, Schindler, Christina E. M., Swope, William C., in ’t Veld, Pieter J., Wagner, Jeffrey, Xue, Bai, Tresadern, Gary

Volltext

Effect of Short Chain Branching on the Interlamellar Structure of Semicrystalline Polyethylene von Kumar, Vaibhaw, Locker, C. Rebecca, in ’t Veld, Pieter J, Rutledge, Gregory C

Volltext

Temperature-Dependent Thermal and Elastic Properties of the Interlamellar Phase of Semicrystalline Polyethylene by Molecular Simulation von in ‘t Veld, Pieter J, Hütter, Markus, Rutledge, Gregory C

Volltext

Morphology and Dynamics in Hydroxide-Conducting Polysulfones von Frischknecht, Amalie L, in ’t Veld, Pieter J, Kolesnichenko, Igor V, Arnot, David J, Lambert, Timothy N

Volltext

Simulation of the Mechanical Strength of a Single Collagen Molecule von in‘t Veld, Pieter J., Stevens, Mark J.

Volltext

Mesoscale hydrodynamics via stochastic rotation dynamics: Comparison with Lennard-Jones fluid von Petersen, Matt K., Lechman, Jeremy B., Plimpton, Steven J., Grest, Gary S., in 't Veld, Pieter J., Schunk, P. R.

Volltext

Multiscale Materials Modeling in an Industrial Environment von Weiß, Horst, Deglmann, Peter, in 't Veld, Pieter J, Cetinkaya, Murat, Schreiner, Eduard

Volltext

Accurate Force Fields for Atomistic Simulations of Oxides, Hydroxides, and Organic Hybrid Materials up to the Micrometer Scale von Kanhaiya, Krishan, Nathanson, Michael, in ’t Veld, Pieter J., Zhu, Cheng, Nikiforov, Ilia, Tadmor, Ellad B., Choi, Yeol Kyo, Im, Wonpil, Mishra, Ratan K., Heinz, Hendrik

Volltext

Liquid-vapor coexistence for nanoparticles of various size von in' t Veld, Pieter J., Horsch, Mark A., Lechman, Jeremy B., Grest, Gary S.

Volltext

Application of Ewald summations to long-range dispersion forces von in 't Veld, Pieter J., Ismail, Ahmed E., Grest, Gary S.

Volltext