Titlebook: Many-Electron Approaches in Physics, Chemistry and Mathematics; A Multidisciplinary Volker Bach,Luigi Delle Site Book 2014 Springer Intern

形容詞

Some (Important?) Unsolved Mathematical Problems in Molecular Simulation related topics. Many such questions exist and the particular choice made here aims to emphasize some specific questions that, again in the author’s opinion, would have important and immediate consequences on the current practice of molecular simulation.

火花

The Computational Complexity of Density Functional Theorysal functional must be approximated resulting in a ‘semi’-ab initio approach. The search for improved functionals has resulted in hundreds of functionals and remains an active research area. This chapter is concerned with understanding fundamental limitations of any algorithmic approach to approxima

假

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通情達(dá)理

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懶鬼才會(huì)衰弱

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彎腰

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stress-test

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Additive

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ALTER

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infinite

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