Efficient parallel linear scaling method to get the response density matrix in all-electron real-space density-functional perturbation theory - researchr publication

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Honghui Shang, WanZhen Liang, Yunquan Zhang, Jinlong Yang. Efficient parallel linear scaling method to get the response density matrix in all-electron real-space density-functional perturbation theory. Computer Physics Communications, 258:107613, 2021. [doi]

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