The mapping of electronic energy distributions using experimental electron density

Tsirelson VG.

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The mapping of electronic energy distributions using experimental electron density

机译：使用实验电子密度的电子能量分布图

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It is demonstrated that the approximate kinetic energy density calculated using the second-order gradient expansion with parameters of the multipole model fitted to experimental structure factors reproduces the main features of this quantity in a molecular or crystal position space. The use of the local virial theorem provides an appropriate derivation of approximate potential energy density and electronic energy density from the experimental (model) electron density and its derivatives. Consideration of these functions is not restricted by the critical points in the electron density and provides a comprehensive characterization of bonding in molecules and crystals. [References: 71]

机译：结果表明，使用二阶梯度膨胀和多极模型的参数拟合实验结构因子计算出的近似动能密度在分子或晶体位置空间中再现了该量的主要特征。局部病毒定理的使用可根据实验（模型）电子密度及其导数适当推导近似的势能密度和电子能量密度。对这些功能的考虑不受电子密度临界点的限制，并提供了分子和晶体中键合的全面表征。 [参考：71]

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《Acta Crystallographica, Section B. Structural Science》 |2002年第4期|共8页
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Tsirelson VG.;
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中图分类晶体学;
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1. The mapping of electronic energy distributions using experimental electron density [J] . Tsirelson VG. Acta Crystallographica, Section B. Structural Science . 2002,第4期

机译：使用实验电子密度的电子能量分布图
2. Understanding electronic and magnetic transitions in ball milled diluted magnetic semiconductor Si 1-xNi x through experimental electron density distribution [J] . R.A.J.R. Sheeba, S. Saravanakumar, S. Israel, Journal of Alloys and Compounds: An Interdisciplinary Journal of Materials Science and Solid-state Chemistry and Physics . 2017,第期

机译：了解球铣削稀释磁半导体中的电子和磁性过渡Si 1-X NI X 通过实验电子密度分布
3. Total photoelectron yield spectroscopy of energy distribution of electronic states density at GaN surface and SiO_2/GaN interface [J] . Ohta Akio, Nguyen Xuan Truyen, Fujimura Nobuyuki, Japanese journal of applied physics . 2018,第6S3期

机译：GaN表面和SiO_2 / GaN界面电子态密度的能量分布的总光电子产率谱
4. A study of density distributions of high energy electrons produced from corona discharge in the air along the radial of reactor by advanced emission spectral method [C] . Wang Wenchun, Su liming International conference on applied electrostatics . 1997

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5. Measurements of metastable atom density using energies and densities of energetic “fast” electrons detected in the electron energy distribution function associated with the afterglow plasma produced by a radio frequency inductively coupled plasma helium discharge [D] . Blessington, Jon C. 2007

机译：使用能量和高能“快速”电子的密度测量亚稳态原子密度，电子能量分布函数中检测到与射频感应耦合等离子体氦放电产生的余辉等离子体相关的电子能量分布函数
6. Studies of Ion Kinetic-Energy Distributions in the Gaseous Electronics Conference RF Reference Cell [O] . J. K. Olthoff, R. J. Van Brunt, S. B. Radovanov 1995

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7. Nonadiabatic Electronic Dynamics in Isolated Molecules and in Solution Studied by Ultrafast Time–Energy Mapping of Photoelectron Distributions [O] . Toshinori Suzuki 2014

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8. Magnetic Mapping of Current Distributions in Two-Dimensional Electronic Devices [R] . Wikswo, J. P. 1988

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The mapping of electronic energy distributions using experimental electron density

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