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A method for constructing semiempirical functions of a Hamiltonian and their application in quantum chemistry

✍ Scribed by M. V. Nikerov; I. V. Stankevich


Publisher
SP MAIK Nauka/Interperiodica
Year
1981
Tongue
English
Weight
365 KB
Volume
22
Category
Article
ISSN
0022-4766

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