Dear VASP Community,
I’m looking to calculate third-order elastic constants for crystalline materials and would like to know if VASP offers any native functionality for this. Thanks in advance!
Best regards,
Zhao
Native Support for Third-Order Elastic Tensor Calculations in VASP.
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hszhao.cn@gmail.com
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Native Support for Third-Order Elastic Tensor Calculations in VASP.
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pedro_melo
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Re: Native Support for Third-Order Elastic Tensor Calculations in VASP.
Dear Zhao,
No, there is no native way to compute the third-order elastic constants.
Kind regards,
Pedro
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hszhao.cn@gmail.com
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Re: Native Support for Third-Order Elastic Tensor Calculations in VASP.
See here for the related discussion.