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Density Functional Theory for Excited States in a Quasi Local Density Approximation.

机译：准局部密度近似下激发态的密度泛函理论。

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摘要

For abstract see ADA164 369.

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作者
Kohn, W.;
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年度 1986
页码 1-11
总页数 11
原文格式 PDF
正文语种 eng
中图分类工业技术;
关键词
Electronic states; Excitation; Probability density functions; Energy; Weighting functions; Eigenvalues;

机译：电子状态;激发;概率密度函数;能量;加权函数;特征值;

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2. Multiconfiguration Pair-Density Functional Theory Outperforms Kohn-Sham Density Functional Theory and Multireference Perturbation Theory for Ground-State and Excited-State Charge Transfer (vol 11, pg 3643, 2015) [J] . Ghosh Soumen, Sonnenberger Andrew L., Moyer Chad E., Journal of chemical theory and computation: JCTC . 2016,第1期

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4. A first principles study of small Cu{sub}n clusters based on local-density and generalized-gradient approximations to density functional theory [C] . Carlo Massobrio, Alfredo Pasquarello, Andrea Dal Corso Symposium D on Computational Modeling of Issues in Materials Science . 1997

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5. Thermal density functional theory, ensemble density functional theory, and potential functional theory for warm dense matter. [D] . Pribram-Jones, Aurora. 2015

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6. Minimal Optimized Effective Potentials for Density Functional Theory Studies on Excited-State Proton Dissociation [O] . Pouya Partovi-Azar, Daniel Sebastiani 2021

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7. Local-density approximation for exchange energy functional in excited-state density functional theory [O] . Samal, Prasanjit, Harbola, Manoj K. 2006

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8. Density Functional Theory for Excited States in a Quasi Local Density Approximation. [R] . Kohn, W. 1986

机译：准局部密度近似下激发态的密度泛函理论。

Density Functional Theory for Excited States in a Quasi Local Density Approximation.

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