simulation with antiferromagnetic material

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chao zhou

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Jun 26, 2022, 10:22:10 PM6/26/22
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Hello , everyone
The cell is a hexagonal cell (in vampire.ucf). I see it can't work it in the manual, because of parallelism, I can only use orthogonal lattice vectors, but I don't use parallelism. Is this a problem? In addition, I want to ask about the writing method of exchange interaction with tensorial, because it is generated by tb2j. What should I do if I want to write it myself?
zhou chao

chao zhou

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Jun 26, 2022, 10:58:25 PM6/26/22
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vampire.mat
vampire.UCF
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