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Public Member Functions | Public Attributes

cclib::parser::orcaparser::ORCA Class Reference

Inheritance diagram for cclib::parser::orcaparser::ORCA:
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Collaboration diagram for cclib::parser::orcaparser::ORCA:
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List of all members.

Public Member Functions

def __init__
def __repr__
def __setattr__
def __str__
def before_parsing
def extract
def float
def normalisesym
def parse
def updateprogress

Public Attributes

 aonames
 aooverlaps
 atombasis
 atomcoords
 atomnos
 charge
 coreelectrons
 coupledcluster
 cupdate
 datatype
 etenergies
 etoscs
 etsecs
 etsyms
 filename
 fupdate
 geotargets
 geovalues
 homos
 isstream
 logger
 loglevel
 logname
 mocoeffs
 moenergies
 mult
 natom
 nbasis
 nmo
 optfinished
 progress
 scfenergies
 scftargets
 scfvalues
 stream
 table
 vibfreqs
 vibirs
 vibramans

Detailed Description

An ORCA log file.

Definition at line 17 of file orcaparser.py.


The documentation for this class was generated from the following file:

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