## Only pomt densI& are sampIed when matnx elements of a delta funclron operator are evaluated Thus, the Ferrm contact contnbution to nuclear spin-spin couphng tensors IS very senslhve IO local ma ccurac~es of the wavefunctloas An alternauve expresslon for the delta function wiuch uses a global re
✦ LIBER ✦
Variation calculation of the NMR spin—spin coupling constant in HD by using a nonsingular contact operator
✍ Scribed by Wolfgang Sänger; Jürgen Voitländer
- Publisher
- Elsevier Science
- Year
- 1975
- Tongue
- English
- Weight
- 588 KB
- Volume
- 9
- Category
- Article
- ISSN
- 0301-0104
No coin nor oath required. For personal study only.
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## Abstract It is demonstrated that in a case where neither the proton nor the natural‐abundance ^13^C‐satellite spectra of a partially oriented molecule carry enough structural information, one can determine the entire molecular geometry by the combined use of several liquid crystals as solvents.