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Compton profiles and momentum expectation values for the H2O, NH3 and CH4 molecules

✍ Scribed by T. Ahlenius; P. Lindner

Publisher
Elsevier Science
Year
1975
Tongue
English
Weight
427 KB
Volume
34
Category
Article
ISSN
0009-2614

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✦ Synopsis

Compton pro&s and expectztion v&es

for p" are computed for the water, ammonia and methane motecules using large scale configuration interaction wavcfunctions.

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A transformation of the transverse Coulomb vector potential was implemented to calculate molecular magnetic properties via the random-phase Ε½ . approximation RPA within the framework of a ''longitudinal gauge.'' In this gauge, the diamagnetic contribution to magnetic susceptibility is a tensor with