Feature: multicollinear LDA & GGA #5460
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jinzx10
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jinzx10
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mohanchen
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Nov 19, 2024
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| // 初始化 Pauli 矩阵 |
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suggest changing this to English notes
| ../xc_functional_vxc.cpp | ||
| ../xc_functional_libxc_vxc.cpp | ||
| ../xc_functional_libxc_tools.cpp | ||
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This PR serves as a test to merge the multicollinear code developed by Xiaoyu Zhang. A formal pull request will be opened later by the code author himself.
Linked Issue
#5379