Nuclear resonant scattering and molecular orbital calculations on an iron(II) spin-crossover complex

被引:18
作者
Grunsteudel, H [1 ]
Paulsen, H
Meyer-Klaucke, W
Winkler, H
Trautwein, AX
Grunsteudel, HF
Baron, AQR
Chumakov, AI
Ruffer, R
Toftlund, H
机构
[1] Univ Lubeck, Inst Phys, D-23538 Lubeck, Germany
[2] European Synchrotron Radiat Facil, Nucl Resonance Grp, F-38043 Grenoble, France
[3] Odense Univ, Dept Chem, DK-5230 Odense M, Denmark
来源
HYPERFINE INTERACTIONS | 1998年 / 113卷 / 1-4期
关键词
D O I
10.1023/A:1012641614937
中图分类号
O64 [物理化学(理论化学)、化学物理学]; O56 [分子物理学、原子物理学];
学科分类号
070203 ; 070304 ; 081704 ; 1406 ;
摘要
Nuclear resonant scattering of synchrotron radiation was applied to investigate the spin-crossover complex Fe(tpa)(NCS)(2) (tpa = tris(2-pyridylmethyl)amine). The nuclear forward scattering experiments are compared with conventional Mossbauer experiments, and the nuclear inelastic scattering experiments are compared with the results from a theoretical normal mode analysis based on molecular orbital calculations.
引用
收藏
页码:311 / 317
页数:7
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