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Simulation of EPR-spectra of randomly oriented samples

✍ Scribed by C. Daul; C.W. Schläpfer; B. Mohos; J. Ammeter; E. Gamp

Publisher
Elsevier Science
Year
1981
Tongue
English
Weight
488 KB
Volume
21
Category
Article
ISSN
0010-4655

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✦ Synopsis

Title of program POWDER dipole-dipole and/or quadxupole interaction of the electronic and nuclear spins. This program calculates the first derivative Catalogue number: ABYG of the EPR absorption spectrum of randomly oriented sam-Program obtainable from: CPC Program Library, Queen's pies using the following approximations: University of Belfast, N. Ireland (see application form in i) the eigenvalues of the spin Hamiltonian axe given by second order perturbation theory; this issue) ii) the intensities of the EPR transitions axe determined by Computer: CDC 6000; Installation: Rechenzentrum der Zeeman interaction only; ETHZ, 8052 Zurich, Switzerland

iii) the paramagnetic species are uniformly or randomly distributed in space. Operating system: SCOPE 3.4 iv) "allowed" transitions (AM 1 = 0) axe calculated only.

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