源码文件
! { dg-do run } ! PR 25806: Functions returning pointers to arrays program a integer, target :: storage(5) integer :: s(3…
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源码文件
subroutine BigRead( InputFile, InputConf, Nham, Nljgrs, Niongrs, Nsp, & MaxSp, MaxSteps, MaxBeads, MaxInt, MaxReal, MaxEE, &…
源码文件
subroutine e6interact( Nb, Xb, Yb, Zb, TYPEb, DAMP2b, DAMP3b, & Nmol, LENGTH, Nham, Nljgrs, & EPS, SIG, CP, ALP,…
源码文件
subroutine CenterOfMass( Length, X, Y, Z, TYPEg, Ngrs, MASS, xcom, ycom, zcom ) implicit none ! This routine calculates the …
源码文件
subroutine e6molecule( Nc, Xc, Yc, Zc, TYPEc, DAMP2c, DAMP3c, & Np, Xp, Yp, Zp, TYPEp, DAMP2p, DAMP3p, & Nham, N…
源码文件
subroutine Fourier_Setup( Kmax, Alpha, CONST, KX, KY, KZ, Nkvec ) implicit none ! This routine calculates the constant part …
源码文件
subroutine Sphere( xc, yc, zc, bondlength, xn, yn, zn, Seed ) implicit none ! This subroutine randomly places a bead on the …
源码文件
subroutine Weights( Nham, stop_h, LNW, PSI_PI ) implicit none integer, intent(in) :: Nham integer, intent(in) :…
源码文件
subroutine Create( InputConf, Nham, Nljgrs, Niongrs, Nsp, & MaxSp, MaxSteps, MaxBeads, & MaxInt, MaxReal, MaxEE, &…
源码文件
subroutine Disp_Rot( MaxSp, Nmol, Nlj, Nion, & Xlj, Ylj, Zlj, TYPElj, DAMPlj2, DAMPlj3, & Xion, Yion, Zion, TYPEion,…