Thirty years of density functional theory in computational chemistry: an overview and extensive assessment of 200 density functionals

Document Details

Document Type
Pub Defense Publication
Publication Date
Jun 21, 2017
Source ID
10.1080/00268976.2017.1333644

Entities

People

  • Martin Head-Gordon
  • Narbe Mardirossian

Organizations

  • Lawrence Berkeley National Laboratory
  • Office of Basic Energy Sciences