Quantum Monte Carlo Treatment of the Charge Transfer and Diradical Electronic Character in a Retinal Chromophore Minimal Model
Zen, Andrea, Coccia, Emanuele, Gozem, Samer, Olivucci, Massimo, Guidoni, LeonardoVolume:
11
Language:
english
Journal:
Journal of Chemical Theory and Computation
DOI:
10.1021/ct501122z
Date:
March, 2015
File:
PDF, 1.25 MB
english, 2015