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XcData Struct Reference

Public Attributes

const XCEvaluatorRestrictedxcEvaluator
int nElectrons
symmMatrixxcm
real xcEnergy
real el
int nThreads

Member Data Documentation

real XcData::el

Referenced by xcWorker().

int XcData::nElectrons

Referenced by getXC_mt(), and xcWorker().

int XcData::nThreads

Referenced by getXC_mt(), and xcWorker().

real XcData::xcEnergy

Referenced by xcWorker().

const XCEvaluatorRestricted* XcData::xcEvaluator

Referenced by getXC_mt(), and xcWorker().

symmMatrix* XcData::xcm

Referenced by getXC_mt(), and xcWorker().


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