Computational limits of classical molecular dynamics simulations

Plimpton, S. | British Library Online Contents | 1995

Structure and dynamics of B2O3 melts and glasses: From ab initio to classical molecular dynamics simulations

Scherer, C. / Schmid, F. / Letz, M. et al. | British Library Online Contents | 2019

Molecular simulations of cement based materials: A comparison between first principles and classical force field calculations

Mutisya, Sylvia M. / de Almeida, James M. / Miranda, Caetano R. | British Library Online Contents | 2017

Comparison of simulations of liquid metals by classical and ab initio molecular dynamics

Mitrokhin, Y. | British Library Online Contents | 2006

Classical molecular dynamics simulations of crystal lattices with truncated Taylor series-based interatomic potentials

Kshirsagar, S. / Mandadapu, K. K. / Papadopoulos, P. | British Library Online Contents | 2016