Multiple Environment Single System Quantum Mechanical/Molecular Mechanical (MESS-QM/MM) Calculations. 1. Estimation of Polarization Energies

Bibliographic Details
Main Authors: Sodt, Alexander J., Mei, Ye, König, Gerhard, Tao, Peng, Steele, Ryan P., Brooks, Bernard R., Shao, Yihan
Format: Online
Language:English
Published: American Chemical Society 2014
Online Access:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4353191/