Testing the r2SCAN Density Functional for the Thermodynamic Stability of Solids with and without a van der Waals Correction

Document Details

Document Type
Pub Defense Publication
Publication Date
Nov 09, 2022
Source ID
10.1021/acsmaterialsau.2c00059

Entities

People

  • Aaron D Kaplan
  • Chris Wolverton
  • Christopher J Bartel
  • Eric B. Isaacs
  • James W Furness
  • Jianwei Sun
  • Jinliang Ning
  • John Perdew
  • Manish Kothakonda

Organizations

  • Air Force Office of Scientific Research
  • Division of Materials Research
  • HRL Laboratories
  • Northwestern University
  • Office of Basic Energy Sciences
  • Temple University
  • Tulane University of Louisiana
  • University of Minnesota