Optimized atomic-like orbitals for first-principles tight-binding molecular dynamics

By M. A. Basanta, Y. Dappe, P. Jelínek, J. Ortega. 2007

136 citations recorded by the source corpus.

Subfields: Atomic and Molecular Physics, and Optics, Materials Chemistry

View Paper: https://www.semanticscholar.org/paper/3b37f4feb4c97279f75a9b6a49c4e6bd08ea207c