Performance of Property-Optimized Basis Sets for Optical Rotation with Coupled Cluster Theory

Document Details

Document Type
Pub Defense Publication
Publication Date
Jun 20, 2018
Source ID
10.1021/acs.jpca.8b04183

Entities

People

  • Angelika Baranowska-Łączkowska
  • Daniel Crawford
  • Imaad M. Ansari
  • J Coleman Howard
  • Shree Sowndarya S. V.
  • Taylor J. Mach

Organizations

  • Concordia University St. Paul
  • Division of Advanced Cyberinfrastructure
  • Division of Chemistry
  • European Regional Development Fund
  • Foundation for Polish Science
  • Kazimierz Wielki University in Bydgoszcz
  • United States Department of Defense
  • Virginia Tech