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自旋污染
释义
自旋污染
Encyclopedia
理学
计算与理论化学
释
spin contamination
自旋污染
采用非限制性自旋轨道(行列式)计算开壳层体系时,由于电子和电子分别进行处理,导致波函数混进了更高自旋态而不再是总自旋的本征函数的现象。
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transition state species
transition state theory
transition state theory (TST)
transition-state wave packet method
transition surface
transition system
transition temperature
transition time
transition town movement
transition width
transition with prohibitions
transition with taboo states
transition zone
transitive
transitive action
transitive binary relation
transitive class
transitive closure
transitive design
transitive digraph
transitive embedding theorem
transitive extension
transitive functional dependency
transitive graph
transitive group
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