Performance of Dispersion-Inclusive Density Functional Theory Methods for Energetic Materials

Document Details

Document Type
Pub Defense Publication
Publication Date
Jun 27, 2022
Source ID
10.1021/acs.jctc.2c00350

Entities

People

  • Dana O’connor
  • Imanuel Bier
  • Noa Marom
  • Yun-ting Hsieh

Organizations

  • Army Research Office
  • Carnegie Mellon University