opan.vpt2.repo¶
Sub-module for HDF5 repo interactions for VPT2 anharmonic calculations.
Warning
Module is under active development. API &c. may change with little notice.
Classes
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class
opan.vpt2.repo.
OpanAnharmRepo
(fname=None)¶ HDF5 repo interface for VPT2 anharmonic calculations.
Operations here DO NOT ensure consistency with the surrounding data. Such consistency must be checked/handled at a higher level. This is just a wrapper class to facilitate I/O interactions!
Currently no chunking or any filters are used. May or may not be worth robustification. Things stored are not likely to be huge....
Instantiation
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__init__
(...)¶
Class Variables
To be documented
Instance Variables
To be documented
Methods
To be documented
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