atomes 1.1.15
atomes: an atomic scale modeling tool box
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sq.F90 File Reference

S(q) analysis: Fourier transform calculation. More...

Go to the source code of this file.

Functions/Subroutines

integer(kind=c_int) function s_of_q (qmax, qmin, nq)
 
integer(kind=c_int) function send_gr (ic, val, dr, rdata, gdata)
 

Detailed Description

S(q) 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 sq.F90.

Function/Subroutine Documentation

◆ s_of_q()

integer (kind=c_int) function s_of_q ( real (kind=c_double), intent(in) qmax,
real (kind=c_double), intent(in) qmin,
integer (kind=c_int), intent(in) nq )

Definition at line 21 of file sq.F90.

◆ send_gr()

integer (kind=c_int) function send_gr ( integer (kind=c_int), intent(in) ic,
integer (kind=c_int), intent(in) val,
real (kind=c_double), intent(in) dr,
real (kind=c_double), dimension(val), intent(in) rdata,
real (kind=c_double), dimension(val), intent(in) gdata )

Definition at line 232 of file sq.F90.