Physics – Condensed Matter – Disordered Systems and Neural Networks
Scientist
Physics
Condensed Matter
Disordered Systems and Neural Networks
Scientist
On the accurate calculation of the dielectric constant and the diffusion coefficient from molecular dynamics simulations: the case of SPC/E water
RMC_POT (Reverse Monte Carlo using POTentials), a computer code for modeling the structure of disordered systems containing molecules of arbitrary complexity, using flexible molecular constraints and non-bonding potentials
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