endocarditis 发表于 2025-3-21 17:34:46
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https://doi.org/10.1007/978-90-481-3862-3ab initio calculations; density functional calculations; molecualr mechanics; potential energy surfaces托运 发表于 2025-3-22 16:13:51
978-90-481-3861-6Springer Science+Business Media B.V. 2011托运 发表于 2025-3-22 18:31:14
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https://doi.org/10.1007/b102617 shown by explaining the Schrödinger equation and showing how this equation led to the simple Hückel method, from which the extended Hückel method followed. This sets the stage well for ab initio theory, in Chapter 5..QM grew out of studies of blackbody radiation and of the photoelectric effect. Bes