Calculated valence electronic structure of 3d metals for use in the X-ray intensity ratio studies

H. Dagistanli; Y. Kalayci; R.H. Mutlu

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Calculated valence electronic structure of 3d metals for use in the X-ray intensity ratio studies

机译：X射线强度比研究中使用的3d金属的化合价电子结构

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摘要

3d occupation numbers of the transition elements corresponding to various types of atomic configurations are calculated by means of the linear muffin-tin orbital (LMTO) method. This data is used with the multiconfiguration Dirac-Fock (MCDF) X-ray intensity ratios to estimate the electron populations of the 3d metals in alloys.

机译：借助于线性松饼-锡轨道（LMTO）方法，计算出与各种原子构型相对应的过渡元素的3d占据数。此数据与多配置狄拉克-福克（MCDF）X射线强度比一起使用，以估计合金中3d金属的电子数量。

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《Radiation Physics and Chemistry》 |2010年第9期|共3页
作者
H. Dagistanli; Y. Kalayci; R.H. Mutlu;
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正文语种 eng
中图分类光学;
关键词
Alloying effect; 3d electron population; X-ray intensity ratio;

机译：合金化作用;3d电子种群;X射线强度比;

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专利

1. Calculated valence electronic structure of 3d metals for use in the X-ray intensity ratio studies [J] . H. Dagistanli, Y. Kalayci, R.H. Mutlu Radiation Physics and Chemistry . 2010,第9期

机译：X射线强度比研究中使用的3d金属的化合价电子结构
2. Kβ/Kα X-RAY INTENSITY RATIO STUDIES ON THE VALENCE ELECTRONIC STATES OF 3d-TRANSITION METALS IN SOME OF THEIR COMPOUNDS [J] . F. PAWLOWSKI, M. POLASIK Acta Physica Polonica. B . 2000,第2期

机译：某些化合物中3d过渡金属的价电子态的Kβ/KαX射线强度比研究
3. Kβ∕Kα X-Ray Intensity Ratio Studies on the Valence Electronic States of 3d-Transition Metals in Some of Their Compounds [J] . F. Paw?owski, M. Polasik, S. Raj, Acta physica Polonica, B. Particle Physics and Field Theory, Nuclear Physics, Theory of Relativity . 2000,第2期

机译：3d-过渡金属在某些化合物中的价电子态的Kβ∕KαX射线强度比研究
4. The atomic ordering dependence of valence electronic structure in half-metallic Co_2Fe(Ga_(0.5)Ge_(0.5)) Heusler alloy observed by hard X-ray photoemission spectroscopy [C] . K. Goto, Y. Sakuraba, Y. Miura, 応用物理学会秋季学術講演会;応用物理学会 . -1

机译：硬X射线光发射光谱法观察半金属Co_2Fe（Ga_（0.5）Ge_（0.5））Heusler合金中价电子结构的原子序依赖性
5. Magnetotransport Studies of Metal-Organic Molecule-Metal Structures: Electronic Transport Through Molecular Films of Alkanedithiols and Valence Tautomers. [D] . Rice, William Charles. 2012

机译：金属有机分子金属结构的磁传输研究：通过链烷二硫醇和价互变异构体分子膜的电子传输。
6. A Restricted Open ConfigurationInteraction with Singles Method To Calculate Valence-to-CoreResonant X-ray Emission Spectra: A Case Study [O] . Dimitrios Maganas, Serena DeBeer, Frank Neese, -1

机译：受限的开放配置与单打交互方法计算价核共振X射线发射光谱：案例研究
7. Valence electronic structure of Mn in undoped and doped lanthanum manganites from relative K x-ray intensity studies [O] . Raj, S., Padhi, H. C., Rayachaudhury, P., 2000

机译：未掺杂和掺杂镧中mn的价电子结构来自相对K x射线强度研究的锰氧化物
8. Design and Development of an Electronic X-Ray Probe for the Study of Alloys and of the Structure of Metals [R] . Duwez, P., Wittry, D. B. 1955

机译：用于合金和金属结构研究的电子X射线探针的设计与开发

Calculated valence electronic structure of 3d metals for use in the X-ray intensity ratio studies

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