Starting from some previously derived results, general closed-form expressions are given for the total number of configurations or structures, the number of configurations of a particular multiplicity, and the total number of antisymmetrized product functions (AP''s), in an N-electron system. The ...
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In this contribution, we extend our framework for analyzing and visualizing correlated many-electron dynamics to non-variational, highly scalable electronic structure method. Specifically, an explicitly time-dependent electronic wave packet is written as a linear combination of $N$-electron wave functions...
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The possibility to use very large basis sets is shown to be a major advantage compared to Full Configuration Interaction approaches, especially for more than five confined electrons.Also, the possibility to utilize two-electron correlation in combination with tailor made potentials to achieve useful ...
An n-n Heterojunction Configuration for Efficient Electron Transport in Organic Photovoltaic Devices Yaohui Li, Xiang Wu, Guangzheng Zuo, Yufei Wang, Xianjie Liu, Yanxian Ma, Bolun Li, Xu-Hui Zhu, Hongbin Wu, Jian Qing, Lintao Hou, Wanzhu Cai...
This is possible due to their reverse biased gated p-i-n diode configuration (Figs. 1a, 1b), which allows at the same time a negligible reverse saturation current when OFF and a conduction mechanism based on band-to-band tunneling of carriers when ON. In order to overcome the intrinsic ...
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