ergo
FirstDrv Struct Reference

A vector of first order derivatives with respect to two parameters: density rho and SQUARE of the gradient of density grho. More...

#include <dft_common.h>

Public Attributes

real fR
 
real fZ
 

Detailed Description

A vector of first order derivatives with respect to two parameters: density rho and SQUARE of the gradient of density grho.

zeta_i = |nabla rho_i|^2

Member Data Documentation

◆ fR

real FirstDrv::fR

◆ fZ

real FirstDrv::fZ

Referenced by dftpot0_(), and xcCallbackGgaR().


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