作品介绍

固体量子化学


作者:叶瓦列斯托夫     整理日期:2022-12-08 16:08:52


  itistraditionalforquantumtheoryofmolecularsystems(molecularquantumchemistry)todescribethepropertiesofamany-atomsystemonthegroundsofin-teratomicinteractionsapplyingthelinearcombinationofatomicorbitals(lcao)approximationintheelectronic-structurecalculations.thebasisofthetheoryoftheelectronicstructureofsolidsistheperiodicityofthecrystallinepotentialandbloch-typeone-electronstates,inthemajorityofcasesapproximatedbyalinearcombina-tionofplanewaves(lcpw).


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