Quantum mechanical cluster calculations of ionic materials: Revision 10 of the ab initio Perturbed Ion program

Computer Physics Communications

Volumn 103, Issue 2-3, 1997, Pages 287-302

  Blanco, Miguel A ^a   Pendás, A Martín ^a   Luana V ^a  

^a UNIVERSITY OF OVIEDO   (Spain)

Author keywords

Electronic structure of ionic materials; Quantum mechanical calculation of local group systems

Indexed keywords

CODES (SYMBOLS); COMPUTATIONAL METHODS; COMPUTER SOFTWARE; ELECTRONIC STRUCTURE; PERTURBATION TECHNIQUES; USER INTERFACES;

IONIC MATERIALS; QUANTUM MECHANICAL CLUSTER CALCULATIONS;

QUANTUM THEORY;

EID: 0031192102     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/s0010-4655(97)00030-1     Document Type: Article

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