atomes 1.1.14
atomes: an atomic scale modeling tool box
Loading...
Searching...
No Matches
grfft.F90 File Reference

g(r) analysis: Fourier transform calculation More...

Go to the source code of this file.

Functions/Subroutines

integer(kind=c_int) function g_of_r_fft (ndr, dtr, mmx)
 
integer function send_sq (ic, val, dtr, kdata, sdata)
 
subroutine fft_to_gr (ltab, ktab, tab, rtab)
 

Detailed Description

g(r) analysis: Fourier transform calculation

Author
Sébastien Le Roux sebas.nosp@m.tien.nosp@m..lero.nosp@m.ux@i.nosp@m.pcms..nosp@m.unis.nosp@m.tra.f.nosp@m.r

Definition in file grfft.F90.

Function/Subroutine Documentation

◆ fft_to_gr()

subroutine fft_to_gr ( integer, intent(in) ltab,
double precision, dimension(ltab), intent(in) ktab,
double precision, dimension(ltab), intent(in) tab,
double precision, dimension(number_of_i), intent(inout) rtab )

Definition at line 227 of file grfft.F90.

◆ g_of_r_fft()

integer (kind=c_int) function g_of_r_fft ( integer (kind=c_int), intent(in) ndr,
real (kind=c_double), intent(in) dtr,
real (kind=c_double), intent(in) mmx )

Definition at line 21 of file grfft.F90.

◆ send_sq()

integer function send_sq ( integer, intent(in) ic,
integer, intent(in) val,
double precision, intent(in) dtr,
double precision, dimension(val), intent(in) kdata,
double precision, dimension(val), intent(in) sdata )

Definition at line 149 of file grfft.F90.