Globally-Optimized Local Pseudopotentials for (Orbital-Free) Density Functional Theory Simulations of Liquids and Solids

  1. Del Rio, B.G.
  2. Dieterich, J.M.
  3. Carter, E.A.
Revue:
Journal of Chemical Theory and Computation

ISSN: 1549-9626,  1549-9618

Année de publication: 2017

Volumen: 13

Número: 8

Pages: 3684-3695

Type: Article

DOI: 10.1021/ACS.JCTC.7B00565 GOOGLE SCHOLAR

Objectifs de Développement Durable