Beyond Point Charges: Dynamic Polarization from Neural Net Predicted Multipole Moments
Darley, Michael G., Handley, Chris M., Popelier, Paul L. A.Volume:
4
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct800166r
Date:
September, 2008
File:
PDF, 1.24 MB
english, 2008