竞选运动 发表于 2025-3-25 06:27:51

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法律 发表于 2025-3-25 09:56:24

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hypertension 发表于 2025-3-25 12:57:22

Drogenabhängigkeit und Substitutionsity-functional theory (TDDFT), with an emphasis on excitons. We review the linear-response formalism for periodic solids, discuss excitonic exchange-correlation kernels, calculate exciton binding energies for various materials, and compare the treatment of excitons with TDDFT and with the Bethe–Sal

nocturnal 发表于 2025-3-25 16:56:00

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明智的人 发表于 2025-3-25 20:16:32

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复习 发表于 2025-3-26 01:23:21

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伸展 发表于 2025-3-26 06:47:19

Demographischer Wandel und Familie recent developments in time-dependent density functional theory (TD-DFT) , spin-orbit coupling (SOC) effects, and non-adiabatic excited states dynamics. Methodological highlights focus on spin-orbit and vibronic couplings and on the recent strategies available for simulating ultra-fast intersystem

Indicative 发表于 2025-3-26 08:58:39

Psychodynamische Familientherapiepy, explaining photoinduced processes, and predicting new phenomena in a variety of specialties, from basic physical-chemistry, through molecular biology, to materials engineering. The demands in the field, however, are quickly growing, and the development of surface hopping based on density functio

无表情 发表于 2025-3-26 15:00:11

https://doi.org/10.1007/978-3-7091-7570-5ls for efficient non-adiabatic population transfer, conical intersections govern the branching ratio of products of such reactions, similar to what the transition states do for ground-state reactivity. In this regard, intersections between the ground and the lowest excited states play a special role

窗帘等 发表于 2025-3-26 18:08:47

Many-Body Perturbation Theory (MBPT) and Time-Dependent Density-Functional Theory (TD-DFT): MBPT Inf . interacting electrons, albeit limited at the time by certain troubling representability questions. As no practical exact form of the exchange-correlation (xc) energy functional was known, the xc-functional had to be approximated, ideally by a local or semilocal functional. Nowadays, however, the
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查看完整版本: Titlebook: Density-Functional Methods for Excited States; Nicolas Ferré,Michael Filatov,Miquel Huix-Rotllant Book 2016 Springer International Publish