Zhang, Changsheng

Polarizable Multipole-Based Force Field for Dimethyl and Trimethyl Phosphate. [electronic resource] - Journal of chemical theory and computation Nov 2015 - 5326-39 p. digital

Publication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, Non-U.S. Gov't; Research Support, U.S. Gov't, Non-P.H.S.

1549-9626

10.1021/acs.jctc.5b00562 doi


Magnesium--chemistry
Models, Molecular
Molecular Dynamics Simulation
Organophosphates--chemistry
Sodium--chemistry
Thermodynamics