Evaluation of redox potentials of cathode materials of alkali-ion batteries using extended DFT+U+U↑↓ method: The role of interactions between the electrons with opposite spins

Evaluation of redox potentials of cathode materials of alkali-ion batteries using extended DFT+U+U↑↓ method: The role of interactions between the electrons with opposite spins
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使用扩展DFT+U+U↑↓方法评估碱离子电池正极材料的氧化还原电位:相反自旋电子之间相互作用的作用

DOI:
10.1063/5.0039594
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发表时间:
2021
期刊:
The Journal of Chemical Physics
影响因子:
--
通讯作者:
Maxim Shishkin* and Hirofumi Sato
Maxim Shishkin* and Hirofumi Sato
中科院分区:
--
文献类型:
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作者:
Shishkin Maxim;Sato Hirofumi;Maxim Shishkin* and Hirofumi Sato

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