Calculation of Magnetic Shielding and Susceptibility of H2O and FOH with Gauge Invariant Gaussian Basis Set
1976 ◽
Vol 31
(12)
◽
pp. 1727-1728
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Keyword(s):
AbstractSusceptibility and magnetic shieldings of all nuclei are calculated for water and hypofluorous acid. A finite perturbation SCF method with gauge invariant gaussian basis set is used. Results calculated with a slightly extended basis set agree well with experimental values.
1977 ◽
Vol 32
(5)
◽
pp. 411-414
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Keyword(s):
Keyword(s):
1980 ◽
Vol 18
(1)
◽
pp. 65-71
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1975 ◽
Vol 48
(12)
◽
pp. 3431-3435
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Keyword(s):
1977 ◽
Vol 47
(1)
◽
pp. 50-54
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2005 ◽
Vol 102
(1)
◽
pp. 1-7
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