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Highly correlated calculations using optimized virtual orbital space with controlled accuracy. Application to counterpoise corrected interaction energy calculations
Michal Kraus, Michal Pitoňák, Pavel Hobza, Miroslav Urban, Pavel NeográdyVolume:
112
Year:
2012
Language:
english
Pages:
12
DOI:
10.1002/qua.23014
File:
PDF, 441 KB
english, 2012