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file  add_gcube.c [code]
file  Allocate_Arrays.c [code]
file  analysis_example.c [code]
file  AngularF.c [code]
file  AtomicDenF.c [code]
file  AtomicPCCF.c [code]
file  Band_DFT_Col.c [code]
file  Band_DFT_Dosout.c [code]
file  Band_DFT_kpath.c [code]
file  Band_DFT_MO.c [code]
file  Band_DFT_NonCol.c [code]
file  bandgnu13.c [code]
file  BentNT.c [code]
file  BroadCast_ComplexMatrix.c [code]
file  BroadCast_ReMatrix.c [code]
file  check_lead.c [code]
file  Cluster_DFT.c [code]
file  Cluster_DFT_Dosout.c [code]
file  Cont_Matrix0.c [code]
file  Cont_Matrix1.c [code]
file  Cont_Matrix2.c [code]
file  Cont_Matrix3.c [code]
file  Contract_Hamiltonian.c [code]
file  Contract_iHNL.c [code]
file  Cutoff.c [code]
file  dampingF.c [code]
file  deri_dampingF.c [code]
file  DFT.c [code]
file  diff_gcube.c [code]
file  diff_geo.c [code]
file  DIIS_Mixing_DM.c [code]
file  DIIS_Mixing_Rhok.c [code]
file  Divide_Conquer.c [code]
file  Divide_Conquer_Dosout.c [code]
file  DosMain.c [code]
file  Dr_AtomicDenF.c [code]
file  Dr_AtomicPCCF.c [code]
file  Dr_RadialF.c [code]
file  Dr_VH_AtomF.c [code]
file  Dr_VNAF.c [code]
file  dtime.c [code]
file  Eff_Hub_Pot.c [code]
file  Eigen_lapack.c [code]
file  Eigen_PHH.c [code]
file  Eigen_PReHH.c [code]
file  EigenBand_lapack.c [code]
file  esp.c [code]
file  EulerAngle_Spin.c [code]
file  f77func.h [code]
file  filA1.py [code]
file  filA3.py [code]
file  File_CntCoes.c [code]
file  Find_ApproxFactN.c [code]
file  Find_CGrids.c [code]
file  find_Emin.c [code]
file  find_Emin0.c [code]
file  find_Emin2.c [code]
file  find_Emin_withS.c [code]
file  Force.c [code]
file  Force_test.c [code]
file  frac2xyz.c [code]
file  Free_Arrays.c [code]
file  FT_NLP.c [code]
file  FT_PAO.c [code]
file  FT_ProductPAO.c [code]
file  FT_ProExpn_VNA.c [code]
file  FT_VNA.c [code]
file  Fuzzy_Weight.c [code]
file  Gaunt.c [code]
file  Gauss_Legendre.c [code]
file  GDivide_Conquer.c [code]
file  GDivide_Conquer_Dosout.c [code]
file  Get_Cnt_dOrbitals.c [code]
file  Get_Cnt_Orbitals.c [code]
file  Get_dOrbitals.c [code]
file  Get_OneD_HS_Col.c [code]
file  Get_Orbitals.c [code]
file  GR_Pulay_DM.c [code]
file  Hamiltonian_Band.c [code]
file  Hamiltonian_Band_NC.c [code]
file  Hamiltonian_Cluster.c [code]
file  Hamiltonian_Cluster_NC.c [code]
file  Hamiltonian_Cluster_SO.c [code]
file  init.c [code]
file  init_alloc_first.c [code]
file  Init_List_YOUSO.c [code]
file  Initial_CntCoes.c [code]
file  Input_std.c [code]
file  Inputtools.c [code]
file  Inputtools.h [code]
file  io_tester.c [code]
file  IS_Hotelling.c [code]
file  IS_Lanczos.c [code]
file  IS_LU.c [code]
file  IS_Taylor.c [code]
file  iterout.c [code]
file  jx.c [code]
file  Kerker_Mixing_Rhok.c [code]
file  Krylov.c [code]
file  Krylov_Dosout.c [code]
file  lapack_dstedc1.c [code]
file  lapack_dstedc2.c [code]
file  lapack_dstegr1.c [code]
file  lapack_dstegr2.c [code]
file  lapack_dsteqr1.c [code]
file  lapack_dstevx1.c [code]
file  lapack_dstevx2.c [code]
file  Lapack_LU_inverse.c [code]
file  lapack_prototypes.h [code]
file  lbfgs.c [code]
file  LU_inverse.c [code]
file  Make_Comm_Worlds.c [code]
file  Make_ESM.c [code]
file  Maketest.c [code]
file  malloc_multidimarray.c [code]
file  MD_pac.c [code]
file  Memory_Leak_test.c [code]
file  Merge_LogFile.c [code]
file  mimic_mpi.c [code]
file  mimic_mpi.h [code]
file  Mio_tester.c [code]
file  Mio_tester2.c [code]
file  Mixing_DM.c [code]
file  mpi_multi_world.c [code]
file  mpi_multi_world2.c [code]
file  Mulliken_Charge.c [code]
file  Nonlocal_Basis.c [code]
file  Nonlocal_RadialF.c [code]
file  Occupation_Number_LDA_U.c [code]
file  openmx.c [code]
file  openmx_common.c [code]
file  openmx_common.h [code]
file  Opt_Contraction.c [code]
file  OpticalConductivityMain.c [code]
file  Orbital_Moment.c [code]
file  OutData.c [code]
file  Output_CompTime.c [code]
file  outputfile1.c [code]
file  Overlap_Band.c [code]
file  Overlap_Cluster.c [code]
file  pdb2pao.c [code]
file  PhiF.c [code]
file  Poisson.c [code]
file  polB.c [code]
file  Pot_NeutralAtom.c [code]
file  PrintMemory.c [code]
file  PrintMemory_Fix.c [code]
file  QuickSort.c [code]
file  RadialF.c [code]
file  read_scfout.c [code]
file  read_scfout.h [code]
file  readfile.c [code]
file  RecursionS_B.c [code]
file  RecursionS_C.c [code]
file  RecursionS_D.c [code]
file  RecursionS_E.c [code]
file  RecursionS_E2.c [code]
file  RecursionS_F.c [code]
file  RecursionS_G.c [code]
file  RecursionS_H.c [code]
file  RecursionS_H2.c [code]
file  RecursionS_I.c [code]
file  ReLU_inverse.c [code]
file  RestartFileDFT.c [code]
file  RF_BesselF.c [code]
file  rmmpi.c [code]
file  rot.c [code]
file  Runtest.c [code]
file  SCF2File.c [code]
file  Set_Aden_Grid.c [code]
file  Set_Allocate_Atom2CPU.c [code]
file  Set_Density_Grid.c [code]
file  Set_Hamiltonian.c [code]
file  Set_Nonlocal.c [code]
file  Set_OLP_Kin.c [code]
file  Set_Orbitals_Grid.c [code]
file  Set_ProExpn_VNA.c [code]
file  Set_Vpot.c [code]
file  Set_XC_Grid.c [code]
file  SetPara_DFT.c [code]
file  setup_CPU_group.c [code]
file  Simple_Mixing_DM.c [code]
file  Smoothing_Func.c [code]
file  Spherical_Bessel.c [code]
file  test.c [code]
file  test0.c [code]
file  test2.c [code]
file  test3.c [code]
file  test_mpi.c [code]
file  test_mpi2.c [code]
file  test_mpi3.c [code]
file  test_mpi4.c [code]
file  Tetrahedron_Blochl.c [code]
file  Timetool.c [code]
file  Total_Energy.c [code]
file  TRAN_adjust_Grid_Origin.c [code]
file  TRAN_adjust_Ngrid.c [code]
file  TRAN_Allocate.c [code]
file  TRAN_Apply_Bias2e.c [code]
file  TRAN_Calc_CentGreen.c [code]
file  TRAN_Calc_CentGreenLesser.c [code]
file  TRAN_Calc_GC_LorR.c [code]
file  TRAN_Calc_GridBound.c [code]
file  TRAN_Calc_OneTransmission.c [code]
file  TRAN_Calc_SelfEnergy.c [code]
file  TRAN_Calc_SurfGreen.c [code]
file  TRAN_Calc_Transmission.c [code]
file  TRAN_Calc_VHartree_G0.c [code]
file  TRAN_Calc_VHartree_Gnon0.c [code]
file  TRAN_Check_Region.c [code]
file  TRAN_Check_Region_Lead.c [code]
file  TRAN_Connect_Read_Density.c [code]
file  TRAN_Connect_Read_Hamiltonian.c [code]
file  TRAN_Credit.c [code]
file  TRAN_Deallocate_Electrode_Grid.c [code]
file  TRAN_Deallocate_RestartFile.c [code]
file  TRAN_Deallocate_SurfOverlap.c [code]
file  TRAN_DFT.c [code]
file  TRAN_DFT_Dosout.c [code]
file  TRAN_Distribute_Node.c [code]
file  TRAN_FFT_interpolation3c.c [code]
file  TRAN_Input_std.c [code]
file  TRAN_Input_std_Atoms.c [code]
file  TRAN_Interp_ElectrodeDensity_Grid.c [code]
file  TRAN_Output_HKS.c [code]
file  TRAN_Output_HKS_Write_Grid.c [code]
file  TRAN_Output_Trans_HS.c [code]
file  TRAN_Output_Transmission.c [code]
file  TRAN_Overwrite_Densitygrid.c [code]
file  TRAN_Overwrite_V2.c [code]
file  TRAN_Poisson.c [code]
file  TRAN_Print.c [code]
file  TRAN_Print_Grid.c [code]
file  tran_prototypes.h [code]
file  TRAN_Read.c [code]
file  TRAN_RestartFile.c [code]
file  TRAN_Set_CentOverlap.c [code]
file  TRAN_Set_Electrode_Grid.c [code]
file  TRAN_Set_IntegPath.c [code]
file  TRAN_Set_MP.c [code]
file  TRAN_Set_PathEnergyStr.c [code]
file  TRAN_Set_SurfOverlap.c [code]
file  TRAN_Set_Value.c [code]
file  tran_variables.h [code]
file  TranMain.c [code]
file  Truncated_System.c [code]
file  truncation.c [code]
file  unit2xyz.c [code]
file  VH_AtomF.c [code]
file  VNAF.c [code]
file  Voronoi_Charge.c [code]
file  Voronoi_Orbital_Moment.c [code]
file  XC_CA_LSDA.c [code]
file  XC_Ceperly_Alder.c [code]
file  XC_EX.c [code]
file  XC_PBE.c [code]
file  XC_PW91C.c [code]
file  xyz2spherical.c [code]
file  zero_cfrac.c [code]


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