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Interpretation of 119 Sn Isomer Shifts and 3D 5/2-Core-Level Shifts Based on Dirac-Slater Calculations on a Number of Ionic States

机译：基于多个离子态的Dirac-slater计算解释119个sn异构体位移和3D 5/2核心水平位移

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Dirac-Slater SCF calculations were performed on a number of tin ions. A simple model for the evaluation of effective valence electron populations based on these calculations is suggested.

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作者
Blomquist, J.;
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年度 1985
页码 p.1-9
总页数 9
原文格式 PDF
正文语种 eng
中图分类工业技术;
关键词
Dirac equation; Isomers; Metal ions; Tin; Electron transitions; Ionization potentials; Molecular relaxation; Relativistic effects; Valence;

机译：Dirac方程;异构体;金属离子;锡;电子跃迁;电离势;分子弛豫;相对论效应;价;

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专利

1. Interpretation of the Sn-119 Mossbauer isomer shifts in complex tin chalcogenides [J] . Lippens PE. Physical Review, B. Condensed Matter . 1999,第7期

机译：复杂锡硫属元素化物中Sn-119 Mossbauer异构体位移的解释
2. DFT Calculations of ~(119)Sn Chemical Shifts Using Gauge-Including Atomic Orbitals and Their Interpretation via Group Properties [J] . Ricardo Vivas-Reyes, Frank De Proft, Monique Biesemans, The journal of physical chemistry, A. Molecules, spectroscopy, kinetics, environment, & general theory . 2002,第11期

机译：DFT计算〜（119）Sn化学位移的过程，包括原子轨道的量规及其通过基团性质的解释
3. Anomalous concentration dependence of the Sn-119 Mossbauer isomer shift of Ag-Sn alloys [J] . Shechter H., Stern EA., Yacoby Y., Journal of Physics. Condensed Matter . 1998,第38期

机译：Ag-Sn合金的Sn-119 Mossbauer异构体位移的反常浓度依赖性
4. Theoretical interpretation of ~(17)O NMR chemical shift in borosilicate glass by molecular orbital calculations [C] . M. Urushihara, S. Sakida, T. Nanba Annual Meeting of The Ceramic Society of Japan . 2005

机译：分子轨道计算硼硅酸盐玻璃中〜（17）o NMR化学位移的理论解释
5. CHEMICALLY-INDUCED CHANGE IN NUCLEAR DECAY RATE AS A TOOL FOR CALIBRATING IRON-57 ISOMER SHIFTS. [D] . VERMA, RAVI NANDAN. 1973

机译：化学诱导的核衰变速率的变化，可作为校正铁57异构体碎片的工具。
6. DFT Calculations of 1H- and 13C-NMR Chemical Shifts of Geometric Isomers of Conjugated Linoleic Acid (18:2 ω-7) and Model Compounds in Solution [O] . Themistoklis Venianakis, Christina Oikonomaki, Michael G. Siskos, 2020

机译：缀合的亚油酸（18：2Ω-7）的几何异构体的DFT计算和13C-NMR化学位移（18：2Ω-7）和溶液中的模型化合物
7. 119Sn and 7Li Solid-State NMR of the Binary LiSn Intermetallics: Structural Fingerprinting and Impact on the Isotropic 119Sn Shift via DFT Calculations [O] . -1

机译：119Sn和7LI固态的二进制LISN金属间质量：结构指纹识别和对各向同性119SN的影响通过DFT计算
8. Electronic Structure and Isomer Shifts of Sn Halides [R] . Terra, J. , Guenzburger, D. 1988

机译：sn卤化物的电子结构和异构体移位

Interpretation of 119 Sn Isomer Shifts and 3D 5/2-Core-Level Shifts Based on Dirac-Slater Calculations on a Number of Ionic States

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