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Searched refs:setoffdiag (Results 1 – 2 of 2) sorted by relevance

/dports/science/qbox/qbox-public-rel1_73_3/src/
H A DD3tensor.h120 void setoffdiag(int i, double b) in setoffdiag() function
140 void setoffdiag(const D3vector& b) in setoffdiag() function
H A DElectricEnthalpy.cpp611 pquad.setoffdiag ( 0, ref[ist*9+6]/np012v - pcor[0] * pcor[1] ); in compute_correction()
612 pquad.setoffdiag ( 1, ref[ist*9+7]/np012v - pcor[1] * pcor[2] ); in compute_correction()
613 pquad.setoffdiag ( 2, ref[ist*9+8]/np012v - pcor[2] * pcor[0] ); in compute_correction()