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Scaled AMO calculations on the hydrogen molecule IV. General remarks
Author(s) -
Brändas Erkki
Publication year - 1968
Publication title -
international journal of quantum chemistry
Language(s) - English
Resource type - Journals
SCImago Journal Rank - 0.484
H-Index - 105
eISSN - 1097-461X
pISSN - 0020-7608
DOI - 10.1002/qua.560020606
Subject(s) - excited state , computation , molecule , hydrogen , hydrogen molecule , physics , computational chemistry , chemistry , mathematical physics , atomic physics , statistical physics , quantum mechanics , mathematics , algorithm
Abstract The scaled version of the AMO method as applied to the hydrogen molecule is discussed. Additional information about previous calculations on H 2 with similar approximations together with computations on excited states (states corresponding to the next lowest root of the secular equation) are reported. The asymptotic behaviour is particularly investigated.