[Phonopy-users] Interface of Phono3py to Abinit
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From: tangdaosheng17 <tan...@16...> - 2020-07-19 10:15:36
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Dear all, I find the brief introduction of Phono3py-Abinit interface in the website of Phono3py. However, in the example of silicon, number of supercell files created from the phono3py for VASP and Abinit POSCAR (unitcell.in) are different. I wonder whether the phono3py can be used with Abinit for thermal conductivity calculations. Thanks, Daosheng -- Dao-Sheng Tang PhD student of Engineering Thermophysics School of Aerospace Engineering Tsinghua University, Beijing, China Email: tan...@ma... |