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exchange-correlation functional
释义
exchange-correlation functional
Encyclopedia
理学
计算与理论化学
释
exchange-correlation functional
交换相关能量泛函
基态总能量中除去了与原相互作用体系相对应的、具有相同电子密度的无相互作用体系动能、电子与外势场之间的作用能和电子间的经典库仑作用能(即哈特里能)之外所剩下的能量贡献。密度泛函理论的核心概念之一。
Physics
凝聚态物理学
固体及其性质
exchange-correlation functional
交换关联泛函
>原子与分子物理学>原子分子的电子结构理论>释义
exchange-correlation functional
交换-关联泛函
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