Simulation of EPR-spectra of randomly oriented samples
| Main Author: | CPC, Mendeley |
|---|---|
| Other Authors: | Daul, C., Schläpfer, C.W., Mohos, B., Ammeter, J., Gamp, E. |
| Format: | Dataset |
| Terbitan: |
Mendeley
, 1981
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| Subjects: | |
| Online Access: |
https:/data.mendeley.com/datasets/nvczkn8jcb |
Daftar Isi:
- Title of program: POWDER Catalogue Id: ABVG_v1_0 Nature of problem The EPR spectra of polycrystalline paramagnetic samples exhibits often complex features due to hyperfine and/or dipole-dipole and/or quadrupole interaction of the electronic and nuclear spins. This program calculates the first derivative of the EPR absorption spectrum of randomly oriented samples using the following approximations: i) the eigenvalues of the spin Hamiltonian are given by second order perturbation theory; ii) theintensities of the EPR transitions are determined by Zeeman interacti ... Versions of this program held in the CPC repository in Mendeley Data ABVG_v1_0; POWDER; 10.1016/0010-4655(81)90015-1 This program has been imported from the CPC Program Library held at Queen's University Belfast (1969-2018)