Fitting electron density as a physically sound basis for the development of interatomic potentials of complex alloys
Ortiz-Roldan, Jose Manuel, Esteban, Gustavo, Lucarini, Sergio, Calero, Sofia, Segurado, Javier, Ruiz-Salvador, A. Rabdel, Hamad, Said, Chacón, Francisco MonteroYear:
2018
Language:
english
Journal:
Physical Chemistry Chemical Physics
DOI:
10.1039/c8cp02591f
File:
PDF, 1.32 MB
english, 2018