Global Optimization of SixHy at the Ab Initio Level via an Iteratively Parametrized Semiempirical Method

International Journal of Quantum Chemistry

Volumn 95, Issue 4-5, 2003, Pages 617-626

  Ge, Yingbin ^a   Head, John D ^a  

^a UNIVERSITY OF HAWAII   (United States)

Author keywords

Ab initio method; Genetic algorithm; Global optimization; Hydride; Parametrization; Semiempirical method

Indexed keywords

GENETIC ALGORITHMS; ITERATIVE METHODS; OPTIMIZATION; SILANES;

SEMIEMPIRICAL METHODS;

NANOSTRUCTURED MATERIALS;

EID: 0242303202     PISSN: 00207608     EISSN: None     Source Type: Journal    
DOI: 10.1002/qua.10630     Document Type: Conference Paper

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