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Magnetic properties of ZrZn2 calculated by the functional integral method

✍ Scribed by J.A. Morkowski; P. Wosicki


Book ID
113314894
Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
231 KB
Volume
80
Category
Article
ISSN
0304-8853

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A direct method for the ab initio calculation of the magnetic susceptibility and chemical shielding tensors based on the individual gauge for localized molecular orbitals (IGLO) formalism is introduced. "Direct" in this context means we avoid storing the two-electron repulsion integrals in favor of