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Accelerating Excitation Energy Computation in Molecules and Solids within Linear-Response Time-Dependent Density Functional Theory via Interpolative Separable Density Fitting Decomposition

机译：通过内插可分离密度拟合分解在线性响应时间依赖性密度函数理论中加速分子和固体的激发能量计算

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1. Accelerating Excitation Energy Computation in Molecules and Solids within Linear-Response Time-Dependent Density Functional Theory via Interpolative Separable Density Fitting Decomposition [J] . Hu Wei, Liu Jie, Li Yingzhou, Journal of chemical theory and computation: JCTC . 2020,第2期

机译：通过内插可分离密度拟合分解在线性响应时间依赖性密度函数理论内加速分子和固体的激励能量计算
2. Accelerating Time-Dependent Density Functional Theory and GW Calculations for Molecules and Nanoclusters with Symmetry Adapted Interpolative Separable Density Fitting [J] . Gao Weiwei, Chelikowsky James R. Journal of chemical theory and computation: JCTC . 2020,第4期

机译：加速时间依赖性密度功能理论和具有对称性的分子和纳米能器的GW计算适应间隔可分离密度拟合
3. Interpolative Separable Density Fitting Decomposition for Accelerating Hybrid Density Functional Calculations with Applications to Defects in Silicon [J] . Hu Wei, Lin Lin, Yang Chao Journal of chemical theory and computation: JCTC . 2017,第11期

机译：用于加速混合密度函数计算的内插可分离密度拟合分解在硅中缺陷的应用
4. Accelerating Optical Absorption Spectra and Exciton Energy Computation via Interpolative Separable Density Fitting [C] . Wei Hu, Meiyue Shao, Andrea Cepellotti, International conference on computational science . 2018

机译：通过插值可分离密度拟合加速光吸收光谱和激子能量计算
5. Accelerating the Computation of Density Functional Theory's Correlation Energy under Random Phase Approximations [D] . Thicke, Kyle. 2019

机译：随机相位近似加速密度函数理论的相关能量计算
6. Prediction of Excitation Energies for Conjugated Oligomers and Polymers from Time-Dependent Density Functional Theory [O] . Jianmin Tao, Sergei Tretiak, Jian-Xin Zhu 2010

机译：从时变密度泛函理论预测共轭低聚物和聚合物的激发能
7. Accelerating Time-Dependent Density Functional Theory and GW Calculations for Molecules and Nanoclusters with Symmetry Adapted Interpolative Separable Density Fitting [O] . -1

机译：加速时间依赖性密度泛函理论和具有对称性的对称性的分子和纳米能器的GW计算适应间隔可分离密度拟合

Accelerating Excitation Energy Computation in Molecules and Solids within Linear-Response Time-Dependent Density Functional Theory via Interpolative Separable Density Fitting Decomposition

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