Jie Deng

Jie Deng

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Posts by Tags

category1

Future Blog Post

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category2

Future Blog Post

less than 1 minute read

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cool posts

Future Blog Post

less than 1 minute read

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This post will show up by default. To disable scheduling of future posts, edit config.yml and set future: false.

install

Pymatgen POTCAR set-up

less than 1 minute read

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Pymatgen POTCAR files set-up requires two step: pmg config -p dir1 dir2 and pmg config -add dir2. One more caveat: dir1 must end as POT_GGA_PAW_PBE.

pymatgen

Pymatgen POTCAR set-up

less than 1 minute read

Published:

Pymatgen POTCAR files set-up requires two step: pmg config -p dir1 dir2 and pmg config -add dir2. One more caveat: dir1 must end as POT_GGA_PAW_PBE.

study

Pymatgen POTCAR set-up

less than 1 minute read

Published:

Pymatgen POTCAR files set-up requires two step: pmg config -p dir1 dir2 and pmg config -add dir2. One more caveat: dir1 must end as POT_GGA_PAW_PBE.