JDFTx  1.7.0
ShapeFunctionSGA13 Namespace Reference

Shape function for [35]. More...

Functions

void expandDensity (const RadialFunctionG &w, double R, const ScalarField &n, ScalarField &nEx, const ScalarField *A_nEx=0, ScalarField *A_n=0, matrix3<> *E_RRT=0)
 Compute expanded density nEx from n, and optionally propagate gradients from nEx to n (accumulate to A_n)
 

Detailed Description

Shape function for [35].