Authors: VandeVondele, J Rothlisberger, U

Citation: J. Vandevondele et U. Rothlisberger, Estimating equilibrium properties from non-Hamiltonian dynamics, J CHEM PHYS, 115(17), 2001, pp. 7859-7864

Authors: VandeVondele, J Magistrato, A Rothlisberger, U

Citation: J. Vandevondele et al., Cis-trans isomerization in triply-bonded ditungsten complexes: A multitudeof possible pathways, INORG CHEM, 40(23), 2001, pp. 5780-5786

Authors: VandeVondele, J Rothlisberger, U

Citation: J. Vandevondele et U. Rothlisberger, Efficient multidimensional free energy calculations for ab initio molecular dynamics using classical bias potentials, J CHEM PHYS, 113(12), 2000, pp. 4863-4868

Authors: Magistrato, A VandeVondele, J Rothlisberger, U

Citation: A. Magistrato et al., Three- and four-center trans effects in triply bonded ditungsten complexes: An ab initio molecular dynamics study of compounds with stoichiometry W2Cl4(NHEt)(2)(PMe3)(2), INORG CHEM, 39(24), 2000, pp. 5553-5560

Authors: VandeVondele, J De Vita, A

Citation: J. Vandevondele et A. De Vita, First-principles molecular dynamics of metallic systems, PHYS REV B, 60(19), 1999, pp. 13241-13244