Abinit wavefunction
Posted: Wed Sep 10, 2014 3:23 am
Hello all,
I have extracted wavefunction coefficient cg and k grid in a sphere kg from WF generated by abinit, I want use these data to rebuild wavefunction phi(k,r). In the calculation the "nspinor" is 2. I find for each plane wave there are four elements of cg for it. I am wondering how to construct wavefunciton use this four coefficients. Thanks.
Best,
Zjuer
I have extracted wavefunction coefficient cg and k grid in a sphere kg from WF generated by abinit, I want use these data to rebuild wavefunction phi(k,r). In the calculation the "nspinor" is 2. I find for each plane wave there are four elements of cg for it. I am wondering how to construct wavefunciton use this four coefficients. Thanks.
Best,
Zjuer