atomate2.lobster.schemas#
Module defining amset document schemas.
Classes
Definition of condensed bonding analysis data from LobsterPy ICOHP. |
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Definition of LOBSTER task document. |
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Definition of input settings for the LOBSTER computation. |
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Definition of computational settings from the LOBSTER computation. |
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Strongest bonds extracted from ICOHPLIST/ICOOPLIST/ICOBILIST from LOBSTER. |