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Perhaps a more elegant method of computing the elastic constants (at any temperature) is to use strain-fluctuations. Penhua Ying has written a nice tutorial here:
So I suggest using the method as in Penghua Ying's tutorial. I don't want to implement the zero-temperature approach for all the crystals any more. Too tedious.
I will think about the grammar carefully. The point is to use a single keyword to calculate the full elastic constant tensor.
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