[Pw_forum] UPF file format

2008-04-10 Thread Paolo Giannozzi
On Apr 9, 2008, at 18:40 , sreekar guddeti wrote: > One naive question... why is the rab(mesh) != r(mesh + 1) - r(mesh) > in the UPF format rab(i)= dF/dx dx, where r(i), the nonuniform grid used in atomic codes, is defined as r(i) = F(x(i)), with x(i) a uniform grid spaced dx, F(x) a

[Pw_forum] UPF file format

2008-04-09 Thread sreekar guddeti
Dear PWSCF users, One naive question... why is the rab(mesh) != r(mesh + 1) - r(mesh) in the UPF format -- Sreekar Guddeti 3rd year Engineering Physics Student Indian Institute of Technology (Bombay) -- next part -- An HTML attachment was scrubbed... URL: