...
机译:最佳时变范围分离混合密度泛函理论的固态光吸收
Department of Materials and Interfaces, Weizmann Institute of Science, Rehovoth 76100, Israel;
Department of Physics, Indian Institute of Science, Bangalore 560 012, India;
Department of Electrical and Computer Engineering and Physics Division of Materials Science and Engineering, Boston University, Boston, Massachusetts 02215, USA;
Department of Physics, University of California Berkeley, Berkeley, California 94720, USA,Molecular Foundry, Lawrence Berkeley National Laboratory, Berkeley, California 94720, USA,Kavli Energy NanoScience Institute at Berkeley, Berkeley, California 94720, USA;
Department of Materials and Interfaces, Weizmann Institute of Science, Rehovoth 76100, Israel;
density functional theory, local density approximation, gradient and other corrections; theory, models, and numerical simulation; semiconductors; photoluminescence, properties and materials;
机译:具有时间依赖性密度功能理论的溶剂化分子的范围分离杂交种的最佳调谐
机译:通过时间依赖性密度泛函理论和距离分离的杂化泛函从头算出官能化八面体倍半硅氧烷的电子吸收
机译:用时间分辨荧光和密度泛函理论的供体受体化合物的热活化延迟荧光的研究应用了最佳调整范围分离的混合功能
机译:时变密度泛函理论计算水团簇的电子激发态吸收光谱
机译:调整后的密度泛函理论应用于随时间变化的光学和按摩特性的密度泛函理论计算。
机译:外价典型芳香族电子谱最佳调整范围分离混合功能的杂环
机译:最佳时变范围分离混合密度泛函理论的固态光吸收