CALCULATION OF THE KNIGHT-SHIFT IN PALLADIUM

被引:3
作者
KRIEGER, R [1 ]
VOITLANDER, J [1 ]
机构
[1] UNIV MUNICH,INST PHYS CHEM,D-8000 MUNICH 2,FED REP GER
来源
ZEITSCHRIFT FUR NATURFORSCHUNG SECTION A-A JOURNAL OF PHYSICAL SCIENCES | 1979年 / 34卷 / 04期
关键词
D O I
10.1515/zna-1979-0420
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
The direct and core-polarization contributions to the Knight shift in palladium metal have been calculated taking an enhancement factor of 10 for d- and 1.28 for s-electrons. We found a large negative contribution of − 3.88% for the core electrons and a comparatively small direct contribution of 0.18% for s-electrons on the Fermi surface. Together with an estimated contribution of 0.36% for conduction electrons in s-orbitals, but not on the Fermi surface, the calculated total amount of −3.34% is in good agreement with the experimental value of −4% obtained by the Jaccarino plot for palladium at 0 K. © 1979, Walter de Gruyter. All rights reserved.
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页码:523 / 524
页数:2
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