Materials Data on Rb3PdF6 by Materials Project

Computed materials data using density functional theory calculations. These calculations determine the electronic structure of bulk materials by solving approximations to the Schrodinger equation. For more information, see https://materialsproject.org/docs/calculations本数据集包含基于密度泛函理论（density functional theory）计算所得的材料数据。此类计算通过求解近似形式的薛定谔方程（Schrödinger equation），以确定块体材料的电子结构。如需了解更多相关信息，请访问：https://materialsproject.org/docs/calculations