/dports/science/openmx/openmx3.8/source/ |
H A D | esp.c | 252 static int i,j,k,ct_AN; in LESP() local 384 static int ct_AN,n1,n2,n3,po,spe; in calc_esp() local 672 static int ct_AN,n1,n2,n3,po,wsp,wan; in find_grids() local 763 static int i,ct_AN,n1,n2,n3; in read_vhart() local 894 static int i,ct_AN,n1,n2,n3; in read_vna() local 959 static int ct_AN; in read_input() local
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H A D | cube2xsf.c | 53 int i, j, k, ii, jj, kk, n, ct_AN, atomnum, Ngrid1, Ngrid2, Ngrid3, spe; in cube2xsf() local 176 int i, j, k, ii, jj, kk, n, ct_AN, atomnum, Ngrid1, Ngrid2, Ngrid3; in cube2xsf_bin() local
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H A D | analysis_example_original.c | 41 static int ct_AN,h_AN,Gh_AN,i,j,TNO1,TNO2; in main() local
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H A D | diff_geo.c | 164 static int ct_AN,num1,num2,po,num_trial; in minimize_rmsd() local 414 static int ct_AN; in rmsd() local 438 static int ct_AN; in read_xyzfiles() local 513 static int ct_AN,num1,num2,po,num_trial; in minimize_md() local 763 static int ct_AN; in md() local
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H A D | Make_FracCoord.c | 28 int i,k,Mc_AN,Gc_AN,ct_AN; in Make_FracCoord() local
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H A D | analysis_example.c | 41 static int ct_AN,h_AN,Gh_AN,i,j,TNO1,TNO2; in main() local
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H A D | Pot_NeutralAtom.c | 17 double Pot_NeutralAtom(int ct_AN, double Gx, double Gy, double Gz) in Pot_NeutralAtom()
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H A D | TRAN_Check_Region_Lead.c | 33 int ct_AN; in TRAN_Check_Region_Lead() local
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H A D | rot.c | 11 static int ct_AN; in main() local
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H A D | bin2txt.c | 65 int i,j,k,n,ct_AN,atomnum,Ngrid1,Ngrid2,Ngrid3; in convert_cube() local 163 int i,j,k,n,ct_AN,atomnum; in convert_xsf() local
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H A D | Allocate_Arrays.c | 8 int i,j,k,ii,L,ct_AN,wan,p,l,al,so,spin; in Allocate_Arrays() local
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H A D | TRAN_Check_Region.c | 35 int ct_AN; in TRAN_Check_Region() local
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H A D | read_scfout.c | 48 static int Gc_AN,ct_AN,h_AN,i,j,can,Gh_AN; in Input() local
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H A D | OutData_Binary.c | 186 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_density() local 457 int ct_AN,spe,i1,i2,i3,GN,i,j,k,digit; in out_Vhart() local 496 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_Vna() local 536 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_Vxc() local 714 int ct_AN,spe,i1,i2,i3,GN,i,j,k,digit; in out_Veff() local 960 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_atomxyz() local 1004 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_atomxsf() local 1055 int n,i1,i2,i3,ct_AN,i,j; in out_coordinates_bulk() local 1759 int ct_AN,n; in Print_CubeTitle() local 2681 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_Partial_Charge_Density() local
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H A D | OutData.c | 200 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_density() local 445 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_Vhart() local 478 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_Vna() local 512 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_Vxc() local 679 int ct_AN,spe,i1,i2,i3,GN,i,j,k; in out_Veff() local 894 int ct_AN,spe,i1,i2,i3,GN,i,j,k,fd; in out_atomxyz() local 939 int ct_AN,spe,i1,i2,i3,GN,i,j,k,fd; in out_atomxsf() local 991 int n,i1,i2,i3,ct_AN,i,j,fd; in out_coordinates_bulk() local 2136 int ct_AN; in Print_CubeTitle() local 2173 int ct_AN,Gc_AN; in Print_CubeTitle2() local [all …]
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H A D | TRAN_Channel_Output.c | 26 int ct_AN; in Print_CubeTitle_EigenChannel() local 68 int ct_AN, n; in Print_CubeTitle_EigenChannel_Bin() local
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H A D | Fuzzy_Weight.c | 26 double Fuzzy_Weight(int ct_AN, int Mc_AN, int Rn, double x, double y, double z) in Fuzzy_Weight()
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H A D | Mixing_DM.c | 24 int spin,ct_AN,wan1,TNO1,h_AN,Gh_AN,wan2; in Mixing_DM() local
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H A D | Free_Arrays.c | 24 int i,j,k,ii,l,L,n,ct_AN,h_AN,wan,al,tno,Cwan,Nc; in array0() local
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H A D | TRAN_Calc_GridBound.c | 55 int ct_AN,ct_AN2,wanA,wanB; in TRAN_Calc_GridBound() local
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H A D | truncation.c | 47 int i,j,k,m,ct_AN,h_AN,Gh_AN,Mc_AN,Gc_AN,s1,s2; in truncation() local 3212 int ct_AN,h_AN,m2,m3,i0,size_RMI1,size_array; in Trn_System() local 3411 int i,j,ct_AN,Rn,wanA,wanB; in Estimate_Trn_System() local 3548 int i,ct_AN,h_AN,Rn,po[4],num; in Check_System() local 3806 int ct_AN,h_AN,i,j,can; in Output_Connectivity() local 3893 int ct_AN,N,n1,n2,n3,Cwan,Rn,Rn1,Ng1,Ng2,Ng3; in UCell_Box() local 5255 int i,j,k,m,ct_AN,h_AN,Gh_AN,Hwan; in free_arrays_truncation0() local
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H A D | check_lead.c | 501 int i,j,ct_AN,spe; in Input_NEGF() local 1105 static int i,ct_AN,spe; in FreeArrays() local
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H A D | jx.c | 60 static int ct_AN,h_AN,Gh_AN,i,j,k,TNO1,TNO2; in main() local 701 static int ct_AN,h_AN,Gh_AN,i,j,TNO1,TNO2; in jx_cluster1() local 1100 static int ct_AN,h_AN,Gh_AN,i,j,TNO1,TNO2; in calc_J_band1() local 1555 static int ct_AN,h_AN,Gh_AN,i,j,TNO1,TNO2; in calc_J_cluster1() local
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H A D | Set_Vpot.c | 35 int Nc,Nd,n1,n2,n3,Cwan,spin,MN,BN,DN,ct_AN; in Set_Vpot() local
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H A D | Band_DFT_kpath.c | 74 int ct_AN,h_AN,wanA,tnoA,wanB,tnoB; in Band_DFT_kpath_Col() local 725 int ct_AN,h_AN,wanA,tnoA,wanB,tnoB; in Band_DFT_kpath_NonCol() local
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