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Higher RPA and second-order polarization propagator calculations of coupling constants in acetylene

✍ Scribed by Jan Geertsen; Jens Oddershede


Book ID
107942178
Publisher
Elsevier Science
Year
1986
Tongue
English
Weight
518 KB
Volume
104
Category
Article
ISSN
0301-0104

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Calculations of spin-spin coupling const
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Nuclear spm-spm couphng CO~SSIIUI~S xc calculakd wth lhc self-consWent polanzation prop~!s~or appro\nn~lron method stmtmg from a scmr-cmpmcJl nonsmglct unstable ~'avcfunct~on. IXccts on o and n rnnsmllrcd componcnrs arc scparatcly analyscd. Results show tht tins approum~tlon IS an adcquatc fraw%orl