The Electronegativity Equalization Method and the Split Charge Equilibration Applied to Organic Systems: Parameterization, Validation and Comparison

T. Verstraelen
http://www.cecam.org/workshop-4-382.html?presentation_id=4196
Talk

Conference / event / venue 

Advances in the Implementation of Polarizable Force Fields for Molecular Simulations, CECAM-HQ-EPFL
Lausanne, Switzerland
Monday, 7 June, 2010 to Wednesday, 9 June, 2010