Mehrotra, Prem K. ; Chandrasekhar, Jayaraman ; Manoharan, Periakaruppan T. ; Subramanian, Sankaran (1979) NDDO MO calculations: isotropic hyperfine coupling constants and nuclear spin-spin coupling constants Chemical Physics Letters, 68 (1). pp. 219-221. ISSN 0009-2614
Full text not available from this repository.
Official URL: http://linkinghub.elsevier.com/retrieve/pii/000926...
Related URL: http://dx.doi.org/10.1016/0009-2614(79)80105-0
Abstract
The nonempirical NDDO MO method in its unrestricted form has been used to evaluate isotropic hyperfine coupling constants and nuclear spin-spin coupling constants. Satisfactory agreement with INDO and experimental results is obtained.
| Item Type: | Article |
|---|---|
| Source: | Copyright of this article belongs to Elsevier Science. |
| ID Code: | 7106 |
| Deposited On: | 25 Oct 2010 12:34 |
| Last Modified: | 30 May 2011 06:56 |
Repository Staff Only: item control page
