Angular dependence of geminal spin–spin
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Jan Geertsen; Jens Oddershede; William T. Raynes
📂
Article
📅
1993
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John Wiley and Sons
🌐
English
⚖ 383 KB
## Abstract Correlated __ab initio__ calculations of the dependences of the proton–proton spin–spin coupling constant __J__(H~1~, __H__~2~) in methane with the variation of the H~1~CH~2~ interbond angle are reported. The other coupling constants, including __J__(C, H), were simultaneously calcula