###################################################################
# #
# Please set a proper CC and LIB for the compilation. #
# Examples of CC and LIB on several platforms are shown below. #
# #
###################################################################
#
# Cray-XC30 (Intel Xeon E5-2670 2.6GHz (Sandy-Bridge))
#
# before 'make install', do
# module unload PrgEnv-cray
# module load PrgEnv-gnu
# module load fftw
#
# CC = cc -Dxt3 -Ofast -march=haswell -mtune=haswell -mno-avx -mno-aes -fsignaling-nans -funroll-all-loops -fopenmp
# or
# CC = cc -Dxt3 -Dscalapack -Ofast -march=haswell -mtune=haswell -mno-avx -mno-aes -fsignaling-nans -funroll-all-loops -fopenmp
# FC = ftn -Dxt3 -Ofast -march=haswell -mtune=haswell -mno-avx -mno-aes -fsignaling-nans -funroll-all-loops -mfpmath=sse -fopenmp
# LIB =
#
# hster (Intel Xeon E5-2680v2, 2.80GHz)
#
# MKLROOT = /opt/intel/mkl
# FFTW = -I/work/t-ozaki/fftw-3.3.4
# LIB= -L/$(MKLROOT)/lib/intel64/ -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -L/work/t-ozaki/fftw-3.3.4/lib -lfftw3 -liomp5 -lifcore -lmpi
# CC = icc -openmp -O3 -xAVX -ip -no-prec-div $(FFTW)
# FC = ifort -openmp -O3 -xAVX -ip -no-prec-div $(FFTW)
#
#
# NO ScaLAPACK version for mx73-vtpcc01 (Intel(R) Xeon(R) CPU E5-2670 @ 2.60GHz)
#
# CC = mpicc -O3 -xHOST -ip -no-prec-div -openmp -I/opt/intel/mkl/include/fftw
# FC = mpif90 -O3 -xHOST -ip -no-prec-div -openmp
# LIB= -L/opt/intel/mkl/lib -mkl=parallel -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -lpthread -lifcore -lmpi -lmpi_f90 -lmpi_f77
#
# or
#
# CC = /usr/local/openmpi-1.4.5/bin/mpicc -O3 -xHOST -ip -no-prec-div -openmp -I/home/ozaki/include -I/home/ozaki/ACML5.3.0/ifort64_mp/include
# FC = /usr/local/openmpi-1.4.5/bin/mpif90 -O3 -xHOST -ip -no-prec-div -openmp -static
# LIB = -L/usr/local/openmpi-1.4.5/lib -lmpi_f77 -lmpi_f90 /home/ozaki/lib/libfftw3.a -L/home/ozaki/ACML5.3.0/ifort64_mp/lib -lacml_mp -Wl,-rpath=/home/ozaki/ACML5.3.0/ifort64_mp/lib -Wl,-rpath=/home/ozaki/ACML5.3.0/ifort64_mp/lib
#
#
# ScaLAPACK version for mx73-vtpcc01 (Intel(R) Xeon(R) CPU E5-2670 @ 2.60GHz)
#
# CC = mpicc -O3 -Dscalapack -xHOST -ip -no-prec-div -openmp -I/opt/intel/mkl/include/fftw
# FC = mpif90 -O3 -xHOST -ip -no-prec-div -openmp
# LIB= -L/opt/intel/mkl/lib -mkl=parallel -lmkl_scalapack_lp64 -lmkl_blacs_openmpi_lp64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -lpthread -lifcore -lmpi -lmpi_f90 -lmpi_f77
#
#
# macloud (Intel(R) Xeon(R) CPU E5-2670 v3 @ 2.30GHz)
#
# FFTW_ROOT = /share/materiapps/fftw/fftw-3.3.4-1
# CC = mpicc -Dxt3 -Ofast -fsignaling-nans -funroll-all-loops -mfpmath=sse -fopenmp -I${FFTW_ROOT}/include
# FC = mpif90 -Dxt3 -Ofast -fsignaling-nans -funroll-all-loops -mfpmath=sse -fopenmp -I${FFTW_ROOT}/include
# LIB = -L${FFTW_ROOT}/lib -lfftw3 -L/usr/local/lib -llapack -lblas -lgfortran -L/usr/lib64/openmpi/lib -lmpi_mpifh
#
#
# phi at CMSI-Kobe (Intel Xeon E5-2670, 2.6GHz)
#
# CC = mpicc -O3 -xHOST -ip -no-prec-div -openmp -I/home/ozaki/include -I/home/ozaki/ACML5.3.0/ifort64_mp/include
# FC = mpifort -O3 -xHOST -ip -no-prec-div -openmp
# LIB = /home/ozaki/fftw-3.3.4/lib/libfftw3.a -L/home/ozaki/ACML5.3.0/ifort64_mp/lib -lacml_mp -Wl,-rpath=/home/ozaki/ACML5.3.0/ifort64_mp/lib -Wl,-rpath=/home/ozaki/ACML5.3.0/ifort64_mp/lib -L/home/issp/usr/lib -lmpichf90 -lmpich -lifcore -limf
#
#
# SGI Altix UV1000 (Intel Xeon E7-8837 (Westmere-EX) [8Core, 24M Cache, 2.66GHz])
#
# CC = icc -openmp -O3 -xHOST -I/opt/intel/mkl/include/fftw -I/opt/sgi/mpt/mpt-2.05/include/
# LIB= -L/opt/sgi/mpt/mpt-2.05/lib/ -L/opt/intel/mkl/lib -mkl=parallel -lifcore -lmpi
# FC = ifort -openmp -O3 -xHOST -I/opt/intel/mkl/include/fftw -I/opt/sgi/mpt/mpt-2.05/include/
#
#
# K-computer at RIKEN
#
# CC = mpifccpx -Dkcomp -Kfast,openmp -I/home/apps/fftw/3.2.2/include
# LIB = -L/home/apps/fftw/3.2.2/lib64 -lfftw3 -SSL2MPI -SSL2BLAMP
# FC = mpifrtpx -Dkcomp -Kfast,openmp
#
#
# FX10 at Univ. of Tokyo
#
# CC = mpifccpx -Dkcomp -Kfast,openmp,SPARC64IXfx -I/usr/local/fftw/3.3/include
# LIB = -L/usr/local/fftw/3.3/lib64 -lfftw3 -SSL2MPI -SSL2BLAMP
# FC = mpifrtpx -Dkcomp -Kfast,openmp,SPARC64IXfx
#
#
# abacus2 (AMD Opteron 2218, 2.6 GHz)
#
# CC =/usr/local/mpich-1.2.7p1/bin/mpicc -tp amd64e -O3 -Dnosse -mp -mcmodel=medium -I/usr/local/fftw3/include
# CC =/usr/local/mpich-1.2.7p1/bin/mpicc -tp amd64e -O3 -mcmodel=medium -I/usr/local/fftw3/include
# FC =/usr/local/mpich-1.2.7p1/bin/mpif90 -tp amd64e -O3 -mcmodel=medium
# LIB = -L/usr/local/fftw3/lib -lfftw3 /usr/local/acml/gnu64/lib/libacml.a /usr/lib64/libg2c.a -pgf90libs
#
#
# pcc (Intel Xeon Nehalem-EP, 2.93 GHz)
#
# CC = mpicc -O2 -xHOST -ip -no-prec-div -openmp -I/opt/intel/mkl/10.2.2.025/include/fftw
# FC = mpif90 -O2 -xHOST -ip -no-prec-div -openmp
# LIB= -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -lguide -lpthread -lifcore
#
#
# chopin2 (Intel Xeon cluster, Xeon X5482, 3.20GHz)
#
# MKLROOT = /opt/intel/mkl/10.0.2.018
# CC = /usr/local/mpich-1.2.7p1/bin/mpicc -openmp -O1 -I/usr/local/include
# FC = /usr/local/mpich-1.2.7p1/bin/mpif90 -openmp -O1 -I/usr/local/include
#LIB = /usr/local/lib/libfftw3.a -L$(MKLROOT)/lib/em64t -Wl,--start-group $(MKLROOT)/lib/em64t/libmkl_lapack.a $(MKLROOT)/lib/em64t/libmkl_intel_lp64.a $(MKLROOT)/lib/em64t/libmkl_intel_thread.a $(MKLROOT)/lib/em64t/libmkl_core.a -Wl,--end-group /opt/intel/fce/10.0.026/lib/libifcore.a
#
#
# vsmp (Intel Xeon SMP cluster, Xeon E5-2690 0 @ 2.90GHz)
#
# MKLROOT=/opt/intel/mkl
# CC=/opt/ScaleMP/mpich2/1.4/bin/mpicc -O3 -fopenmp -I/work/duytvt/fftw-3.3.3/include -I/opt/intel/mkl/include
# FC=/opt/ScaleMP/mpich2/1.4/bin/mpif90 -O3 -fopenmp -I/opt/intel/mkl/include
# LIB= -L/work/duytvt/fftw-3.3.3/lib -lfftw3 -L/opt/intel/mkl/lib/intel64/ -L/opt/intel/composer_xe_2011_sp1.6.233/compiler/lib/intel64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -liomp5 -lpthread -lgfortran
#
#
# s078-065 (Intel Xeon cluster, Xeon(R) CPU 5160 @ 3.00GHz)
#
# CC = /opt/MPICH/1.2.7/pgi/bin/mpipgcc -fast -mp -Dnosse -I/opt/acml5.3.0/ifort64_mp/include -I/opt/fftw-3.3.3/include
# FC = /opt/MPICH/1.2.7/pgi/bin/mpipgf90 -fast -mp -I/opt/acml5.3.0/ifort64_mp/include
# LIB= -L/opt/acml5.3.0/ifort64_mp/lib -lacml_mp -liomp5 -Wl,-rpath=/opt/acml5.3.0/ifort64_mp/lib -Wl,-rpath=/opt/acml5.3.0/ifort64_mp/lib -L/opt/fftw-3.3.3/lib -lfftw3 -pgf90libs
#
CC = mpicc -O3 -xHOST -ip -no-prec-div -openmp -I/opt/intel/mkl/include/fftw
FC = mpif90 -O3 -xHOST -ip -no-prec-div -openmp
LIB= -L/opt/intel/mkl/lib -mkl=parallel -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core -lpthread -lifcore -lmpi -lmpi_f90 -lmpi_f77
CFLAGS = -g
OBJS = openmx.o openmx_common.o Input_std.o Inputtools.o \
init.o LU_inverse.o ReLU_inverse.o \
truncation.o readfile.o FT_PAO.o FT_NLP.o \
FT_ProExpn_VNA.o FT_VNA.o FT_ProductPAO.o \
Hamiltonian_Cluster.o Hamiltonian_Cluster_Hs.o Overlap_Cluster.o Hamiltonian_Band.o \
Overlap_Band.o Hamiltonian_Cluster_NC.o Hamiltonian_Band_NC.o \
Hamiltonian_Cluster_SO.o Get_OneD_HS_Col.o SetPara_DFT.o \
XC_Ceperly_Alder.o XC_CA_LSDA.o XC_PW92C.o XC_PBE.o XC_EX.o \
DFT.o Mixing_DM.o Mixing_H.o Force.o Stress.o Poisson.o Poisson_ESM.o \
Cluster_DFT.o Cluster_DFT_ScaLAPACK.o Cluster_DFT_Dosout.o Cluster_DFT_ON2.o \
Band_DFT_Col.o Band_DFT_Col_ScaLAPACK.o Band_DFT_NonCol.o Band_DFT_kpath.o \
Band_DFT_MO.o Unfolding_Bands.o Band_DFT_Dosout.o Set_Density_Grid.o \
Set_Orbitals_Grid.o Set_Aden_Grid.o \
Gauss_Legendre.o zero_cfrac.o xyz2spherical.o AngularF.o \
RadialF.o Dr_RadialF.o PhiF.o VNAF.o Dr_VNAF.o VH_AtomF.o \
Dr_VH_AtomF.o RF_BesselF.o QuickSort.o \
Nonlocal_RadialF.o KumoF.o Dr_KumoF.o Mulliken_Charge.o \
Occupation_Number_LDA_U.o Eff_Hub_Pot.o \
EulerAngle_Spin.o Smoothing_Func.o Orbital_Moment.o \
Pot_NeutralAtom.o \
Simple_Mixing_DM.o DIIS_Mixing_DM.o ADIIS_Mixing_DM.o GR_Pulay_DM.o \
Kerker_Mixing_Rhok.o DIIS_Mixing_Rhok.o \
Total_Energy.o Contract_Hamiltonian.o Contract_iHNL.o \
Cont_Matrix0.o Cont_Matrix1.o Cont_Matrix2.o Cont_Matrix3.o Cont_Matrix4.o \
Opt_Contraction.o Initial_CntCoes.o Initial_CntCoes2.o Set_XC_Grid.o \
Get_Orbitals.o Get_dOrbitals.o Get_Cnt_Orbitals.o \
Get_Cnt_dOrbitals.o Gaunt.o Find_CGrids.o MD_pac.o \
RestartFileDFT.o Output_CompTime.o Merge_LogFile.o Make_FracCoord.o \
Make_InputFile_with_FinalCoord.o Output_Energy_Decomposition.o \
Divide_Conquer.o Krylov.o EC.o \
Divide_Conquer_Dosout.o \
Eigen_lapack.o Eigen_lapack2.o Eigen_lapack3.o EigenBand_lapack.o \
Eigen_PReHH.o BroadCast_ReMatrix.o \
Eigen_PHH.o BroadCast_ComplexMatrix.o \
lapack_dstedc1.o lapack_dstedc2.o lapack_dstedc3.o\
lapack_dstegr1.o lapack_dstegr2.o lapack_dstegr3.o \
lapack_dstevx1.o lapack_dstevx2.o lapack_dstevx3.o \
lapack_dstevx4.o lapack_dstevx5.o lapack_dsteqr1.o \
Nonlocal_Basis.o Set_OLP_Kin.o Set_Nonlocal.o Set_ProExpn_VNA.o \
Set_Hamiltonian.o Set_Vpot.o \
Voronoi_Charge.o Voronoi_Orbital_Moment.o Fuzzy_Weight.o \
dampingF.o deri_dampingF.o Spherical_Bessel.o \
iterout.o iterout_md.o Allocate_Arrays.o Free_Arrays.o \
Init_List_YOUSO.o outputfile1.o \
malloc_multidimarray.o PrintMemory.o PrintMemory_Fix.o \
dtime.o OutData.o OutData_Binary.o init_alloc_first.o File_CntCoes.o \
SCF2File.o mimic_sse.o Make_Comm_Worlds.o \
Set_Allocate_Atom2CPU.o Cutoff.o Generating_MP_Special_Kpt.o \
Maketest.o Runtest.o Memory_Leak_test.o \
Force_test.o Stress_test.o Show_DFT_DATA.o Generate_Wannier.o \
TRAN_Allocate.o TRAN_DFT.o TRAN_DFT_Dosout.o TRAN_Apply_Bias2e.o \
TRAN_Deallocate_Electrode_Grid.o TRAN_Deallocate_RestartFile.o \
TRAN_RestartFile.o TRAN_Calc_CentGreen.o TRAN_Input_std.o \
TRAN_Set_CentOverlap.o TRAN_Calc_CentGreenLesser.o \
TRAN_Input_std_Atoms.o TRAN_Set_Electrode_Grid.o \
TRAN_Calc_GridBound.o TRAN_Set_IntegPath.o TRAN_Output_HKS.o \
TRAN_Set_MP.o TRAN_Calc_SelfEnergy.o TRAN_Output_Trans_HS.o \
TRAN_Calc_Hopping_G.o TRAN_Calc_SurfGreen.o TRAN_Set_SurfOverlap.o \
TRAN_Add_Density_Lead.o TRAN_Add_ADensity_Lead.o TRAN_Set_Value.o \
TRAN_Poisson.o TRAN_adjust_Ngrid.o TRAN_Print.o TRAN_Print_Grid.o \
Lapack_LU_inverse.o TRAN_Distribute_Node.o TRAN_Output_HKS_Write_Grid.o \
TRAN_Credit.o TRAN_Check_Region_Lead.o TRAN_Check_Region.o TRAN_Check_Input.o \
DFTDvdW_init.o DFTD3vdW_init.o neb.o neb_run.o neb_check.o cellopt.o \
TRAN_Allocate_NC.o TRAN_DFT_NC.o TRAN_Set_CentOverlap_NC.o TRAN_Set_SurfOverlap_NC.o \
TRAN_Calc_OneTransmission.o TRAN_Main_Analysis.o TRAN_Main_Analysis_NC.o \
MTRAN_EigenChannel.o TRAN_Channel_Functions.o TRAN_Channel_Output.o \
TRAN_Calc_CurrentDensity.o TRAN_CDen_Main.o \
elpa1.o solve_evp_real.o solve_evp_complex.o \
NBO_Cluster.o NBO_Krylov.o \
# PROG = openmx.exe
# PROG = openmx
#-----------------------------------------------------------------------
# EXX and LIBERI
#-----------------------------------------------------------------------
LIBERIDIR = ./liberi-091216/source
OBJS += exx.o exx_index.o exx_vector.o exx_log.o exx_step1.o exx_step2.o\
exx_file_overlap.o exx_file_eri.o exx_interface_openmx.o \
exx_debug.o exx_xc.o exx_rhox.o
OBJS += $(LIBERIDIR)/eri.o $(LIBERIDIR)/eri_ll.o $(LIBERIDIR)/eri_sf.o\
$(LIBERIDIR)/eri_interpolate.o $(LIBERIDIR)/eri_gtbl.o\
$(LIBERIDIR)/sbt/eri_sbt.o $(LIBERIDIR)/sbt/log/eri_fsbt.o\
$(LIBERIDIR)/sbt/log/eri_logfsbt.o\
$(LIBERIDIR)/sbt/linear/eri_linfsbt.o
CC += -I$(LIBERIDIR)
#
# set program name
# destination directory
#
PROG = openmx
DESTDIR = ../work
UTIL = DosMain jx analysis_example esp polB bandgnu13 bin2txt cube2xsf intensity_map md2axsf
#
# OpenMX
#
openmx: $(OBJS)
$(CC) $(OBJS) $(STACK) $(LIB) -lm -o openmx
#
#
# all
#
#
all: $(PROG) $(UTIL)
cp $(PROG) $(UTIL) $(DESTDIR)/
openmx.o: openmx.c openmx_common.h tran_variables.h tran_prototypes.h
$(CC) -c openmx.c
openmx_common.o: openmx_common.c openmx_common.h
$(CC) -c openmx_common.c
Input_std.o: Input_std.c openmx_common.h Inputtools.h tran_prototypes.h
$(CC) -c Input_std.c
Inputtools.o: Inputtools.c
$(CC) -c Inputtools.c
init.o: init.c openmx_common.h
$(CC) -c init.c
LU_inverse.o: LU_inverse.c openmx_common.h
$(CC) -c LU_inverse.c
ReLU_inverse.o: ReLU_inverse.c openmx_common.h
$(CC) -c ReLU_inverse.c
truncation.o: truncation.c openmx_common.h tran_prototypes.h
$(CC) -c truncation.c
Find_CGrids.o: Find_CGrids.c openmx_common.h
$(CC) -c Find_CGrids.c
readfile.o: readfile.c openmx_common.h
$(CC) -c readfile.c
#
#
#
Hamiltonian_Cluster.o: Hamiltonian_Cluster.c openmx_common.h
$(CC) -c Hamiltonian_Cluster.c
Hamiltonian_Cluster_Hs.o: Hamiltonian_Cluster_Hs.c openmx_common.h
$(CC) -c Hamiltonian_Cluster_Hs.c
Overlap_Cluster.o: Overlap_Cluster.c openmx_common.h
$(CC) -c Overlap_Cluster.c
Hamiltonian_Band.o: Hamiltonian_Band.c openmx_common.h
$(CC) -c Hamiltonian_Band.c
Overlap_Band.o: Overlap_Band.c openmx_common.h
$(CC) -c Overlap_Band.c
Hamiltonian_Cluster_NC.o: Hamiltonian_Cluster_NC.c openmx_common.h
$(CC) -c Hamiltonian_Cluster_NC.c
Hamiltonian_Cluster_SO.o: Hamiltonian_Cluster_SO.c openmx_common.h
$(CC) -c Hamiltonian_Cluster_SO.c
Hamiltonian_Band_NC.o: Hamiltonian_Band_NC.c openmx_common.h
$(CC) -c Hamiltonian_Band_NC.c
Get_OneD_HS_Col.o: Get_OneD_HS_Col.c openmx_common.h
$(CC) -c Get_OneD_HS_Col.c
#
#
#
SetPara_DFT.o: SetPara_DFT.c openmx_common.h
$(CC) -c SetPara_DFT.c
XC_Ceperly_Alder.o: XC_Ceperly_Alder.c openmx_common.h
$(CC) -c XC_Ceperly_Alder.c
XC_CA_LSDA.o: XC_CA_LSDA.c openmx_common.h
$(CC) -c XC_CA_LSDA.c
XC_PW92C.o: XC_PW92C.c openmx_common.h
$(CC) -c XC_PW92C.c
XC_PBE.o: XC_PBE.c openmx_common.h
$(CC) -c XC_PBE.c
XC_EX.o: XC_EX.c openmx_common.h
$(CC) -c XC_EX.c
#
# SCF
#
DFT.o: DFT.c openmx_common.h tran_prototypes.h
$(CC) -c DFT.c
Cluster_DFT.o: Cluster_DFT.c openmx_common.h
$(CC) -c Cluster_DFT.c
Cluster_DFT_ScaLAPACK.o: Cluster_DFT_ScaLAPACK.c openmx_common.h
$(CC) -c Cluster_DFT_ScaLAPACK.c
Cluster_DFT_Dosout.o: Cluster_DFT_Dosout.c openmx_common.h
$(CC) -c Cluster_DFT_Dosout.c
Cluster_DFT_ON2.o: Cluster_DFT_ON2.c openmx_common.h
$(CC) -c Cluster_DFT_ON2.c
Band_DFT_Col.o: Band_DFT_Col.c openmx_common.h
$(CC) -c Band_DFT_Col.c
Band_DFT_Col_ScaLAPACK.o: Band_DFT_Col_ScaLAPACK.c openmx_common.h
$(CC) -c Band_DFT_Col_ScaLAPACK.c
Band_DFT_NonCol.o: Band_DFT_NonCol.c openmx_common.h
$(CC) -c Band_DFT_NonCol.c
Band_DFT_kpath.o: Band_DFT_kpath.c openmx_common.h
$(CC) -c Band_DFT_kpath.c
Band_DFT_MO.o: Band_DFT_MO.c openmx_common.h
$(CC) -c Band_DFT_MO.c
Unfolding_Bands.o: Unfolding_Bands.c openmx_common.h
$(CC) -c Unfolding_Bands.c
Band_DFT_Dosout.o: Band_DFT_Dosout.c openmx_common.h
$(CC) -c Band_DFT_Dosout.c
Mixing_DM.o: Mixing_DM.c openmx_common.h
$(CC) -c Mixing_DM.c
Mixing_H.o: Mixing_H.c openmx_common.h
$(CC) -c Mixing_H.c
Force.o: Force.c openmx_common.h
$(CC) -c Force.c
Stress.o: Stress.c openmx_common.h
$(CC) -c Stress.c
Poisson.o: Poisson.c openmx_common.h
$(CC) -c Poisson.c
Poisson_ESM.o: Poisson_ESM.c openmx_common.h
$(CC) -c Poisson_ESM.c
Mulliken_Charge.o: Mulliken_Charge.c openmx_common.h
$(CC) -c Mulliken_Charge.c
Occupation_Number_LDA_U.o: Occupation_Number_LDA_U.c openmx_common.h
$(CC) -c Occupation_Number_LDA_U.c
Eff_Hub_Pot.o: Eff_Hub_Pot.c openmx_common.h
$(CC) -c Eff_Hub_Pot.c
EulerAngle_Spin.o: EulerAngle_Spin.c openmx_common.h
$(CC) -c EulerAngle_Spin.c
Orbital_Moment.o: Orbital_Moment.c openmx_common.h
$(CC) -c Orbital_Moment.c
Smoothing_Func.o: Smoothing_Func.c openmx_common.h
$(CC) -c Smoothing_Func.c
Gauss_Legendre.o: Gauss_Legendre.c openmx_common.h
$(CC) -c Gauss_Legendre.c
zero_cfrac.o: zero_cfrac.c openmx_common.h
$(CC) -c zero_cfrac.c
xyz2spherical.o: xyz2spherical.c openmx_common.h
$(CC) -c xyz2spherical.c
AngularF.o: AngularF.c openmx_common.h
$(CC) -c AngularF.c
RadialF.o: RadialF.c openmx_common.h
$(CC) -c RadialF.c
Dr_RadialF.o: Dr_RadialF.c openmx_common.h
$(CC) -c Dr_RadialF.c
PhiF.o: PhiF.c openmx_common.h
$(CC) -c PhiF.c
VNAF.o: VNAF.c openmx_common.h
$(CC) -c VNAF.c
Dr_VNAF.o: Dr_VNAF.c openmx_common.h
$(CC) -c Dr_VNAF.c
VH_AtomF.o: VH_AtomF.c openmx_common.h
$(CC) -c VH_AtomF.c
Dr_VH_AtomF.o: Dr_VH_AtomF.c openmx_common.h
$(CC) -c Dr_VH_AtomF.c
RF_BesselF.o: RF_BesselF.c openmx_common.h
$(CC) -c RF_BesselF.c
Nonlocal_RadialF.o: Nonlocal_RadialF.c openmx_common.h
$(CC) -c Nonlocal_RadialF.c
Set_Orbitals_Grid.o: Set_Orbitals_Grid.c openmx_common.h
$(CC) -c Set_Orbitals_Grid.c
Set_Density_Grid.o: Set_Density_Grid.c openmx_common.h
$(CC) -c Set_Density_Grid.c
Set_Aden_Grid.o: Set_Aden_Grid.c openmx_common.h
$(CC) -c Set_Aden_Grid.c
KumoF.o: KumoF.c openmx_common.h
$(CC) -c KumoF.c
Dr_KumoF.o: Dr_KumoF.c openmx_common.h
$(CC) -c Dr_KumoF.c
Pot_NeutralAtom.o: Pot_NeutralAtom.c openmx_common.h
$(CC) -c Pot_NeutralAtom.c
Simple_Mixing_DM.o: Simple_Mixing_DM.c openmx_common.h
$(CC) -c Simple_Mixing_DM.c
DIIS_Mixing_DM.o: DIIS_Mixing_DM.c openmx_common.h
$(CC) -c DIIS_Mixing_DM.c
ADIIS_Mixing_DM.o: ADIIS_Mixing_DM.c openmx_common.h
$(CC) -c ADIIS_Mixing_DM.c
GR_Pulay_DM.o: GR_Pulay_DM.c openmx_common.h
$(CC) -c GR_Pulay_DM.c
Kerker_Mixing_Rhok.o: Kerker_Mixing_Rhok.c openmx_common.h
$(CC) -c Kerker_Mixing_Rhok.c
DIIS_Mixing_Rhok.o: DIIS_Mixing_Rhok.c openmx_common.h
$(CC) -c DIIS_Mixing_Rhok.c
Total_Energy.o: Total_Energy.c openmx_common.h
$(CC) -c Total_Energy.c
Contract_Hamiltonian.o: Contract_Hamiltonian.c openmx_common.h
$(CC) -c Contract_Hamiltonian.c
Contract_iHNL.o: Contract_iHNL.c openmx_common.h
$(CC) -c Contract_iHNL.c
Cont_Matrix0.o: Cont_Matrix0.c openmx_common.h
$(CC) -c Cont_Matrix0.c
Cont_Matrix1.o: Cont_Matrix1.c openmx_common.h
$(CC) -c Cont_Matrix1.c
Cont_Matrix2.o: Cont_Matrix2.c openmx_common.h
$(CC) -c Cont_Matrix2.c
Cont_Matrix3.o: Cont_Matrix3.c openmx_common.h
$(CC) -c Cont_Matrix3.c
Cont_Matrix4.o: Cont_Matrix4.c openmx_common.h
$(CC) -c Cont_Matrix4.c
Opt_Contraction.o: Opt_Contraction.c openmx_common.h
$(CC) -c Opt_Contraction.c
Initial_CntCoes.o: Initial_CntCoes.c openmx_common.h
$(CC) -c Initial_CntCoes.c
Initial_CntCoes2.o: Initial_CntCoes2.c openmx_common.h
$(CC) -c Initial_CntCoes2.c
Set_XC_Grid.o: Set_XC_Grid.c openmx_common.h
$(CC) -c Set_XC_Grid.c
Get_Orbitals.o: Get_Orbitals.c openmx_common.h
$(CC) -c Get_Orbitals.c
Get_dOrbitals.o: Get_dOrbitals.c openmx_common.h
$(CC) -c Get_dOrbitals.c
Get_Cnt_Orbitals.o: Get_Cnt_Orbitals.c openmx_common.h
$(CC) -c Get_Cnt_Orbitals.c
Get_Cnt_dOrbitals.o: Get_Cnt_dOrbitals.c openmx_common.h
$(CC) -c Get_Cnt_dOrbitals.c
Gaunt.o: Gaunt.c openmx_common.h
$(CC) -c Gaunt.c
RestartFileDFT.o: RestartFileDFT.c openmx_common.h
$(CC) -c RestartFileDFT.c
Output_CompTime.o: Output_CompTime.c openmx_common.h
$(CC) -c Output_CompTime.c
Output_Energy_Decomposition.o: Output_Energy_Decomposition.c openmx_common.h
$(CC) -c Output_Energy_Decomposition.c
Merge_LogFile.o: Merge_LogFile.c openmx_common.h
$(CC) -c Merge_LogFile.c
Make_FracCoord.o: Make_FracCoord.c openmx_common.h
$(CC) -c Make_FracCoord.c
Make_InputFile_with_FinalCoord.o: Make_InputFile_with_FinalCoord.c openmx_common.h
$(CC) -c Make_InputFile_with_FinalCoord.c
#
#
#
QuickSort.o: QuickSort.c openmx_common.h
$(CC) -c QuickSort.c
Eigen_lapack.o: Eigen_lapack.c openmx_common.h lapack_prototypes.h
$(CC) -c Eigen_lapack.c
Eigen_lapack2.o: Eigen_lapack2.c openmx_common.h lapack_prototypes.h
$(CC) -c Eigen_lapack2.c
Eigen_lapack3.o: Eigen_lapack3.c openmx_common.h lapack_prototypes.h
$(CC) -c Eigen_lapack3.c
EigenBand_lapack.o: EigenBand_lapack.c openmx_common.h lapack_prototypes.h
$(CC) -c EigenBand_lapack.c
Eigen_PReHH.o: Eigen_PReHH.c openmx_common.h
$(CC) -c Eigen_PReHH.c
Eigen_PHH.o: Eigen_PHH.c openmx_common.h
$(CC) -c Eigen_PHH.c
BroadCast_ReMatrix.o: BroadCast_ReMatrix.c openmx_common.h
$(CC) -c BroadCast_ReMatrix.c
BroadCast_ComplexMatrix.o: BroadCast_ComplexMatrix.c openmx_common.h
$(CC) -c BroadCast_ComplexMatrix.c
lapack_dstedc1.o: lapack_dstedc1.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstedc1.c
lapack_dstedc2.o: lapack_dstedc2.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstedc2.c
lapack_dstedc3.o: lapack_dstedc3.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstedc3.c
lapack_dstegr1.o: lapack_dstegr1.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstegr1.c
lapack_dstegr2.o: lapack_dstegr2.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstegr2.c
lapack_dstegr3.o: lapack_dstegr3.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstegr3.c
lapack_dstevx1.o: lapack_dstevx1.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstevx1.c
lapack_dstevx2.o: lapack_dstevx2.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstevx2.c
lapack_dstevx3.o: lapack_dstevx3.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstevx3.c
lapack_dstevx4.o: lapack_dstevx4.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstevx4.c
lapack_dstevx5.o: lapack_dstevx5.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dstevx5.c
lapack_dsteqr1.o: lapack_dsteqr1.c openmx_common.h lapack_prototypes.h
$(CC) -c lapack_dsteqr1.c
Nonlocal_Basis.o: Nonlocal_Basis.c openmx_common.h
$(CC) -c Nonlocal_Basis.c
Set_OLP_Kin.o: Set_OLP_Kin.c openmx_common.h
$(CC) -c Set_OLP_Kin.c
Set_Nonlocal.o: Set_Nonlocal.c openmx_common.h
$(CC) -c Set_Nonlocal.c
Set_ProExpn_VNA.o: Set_ProExpn_VNA.c openmx_common.h
$(CC) -c Set_ProExpn_VNA.c
Set_Hamiltonian.o: Set_Hamiltonian.c openmx_common.h
$(CC) -c Set_Hamiltonian.c
Set_Vpot.o: Set_Vpot.c openmx_common.h
$(CC) -c Set_Vpot.c
#
#
#
FT_PAO.o: FT_PAO.c openmx_common.h
$(CC) -c FT_PAO.c
FT_NLP.o: FT_NLP.c openmx_common.h
$(CC) -c FT_NLP.c
FT_ProExpn_VNA.o: FT_ProExpn_VNA.c openmx_common.h
$(CC) -c FT_ProExpn_VNA.c
FT_VNA.o: FT_VNA.c openmx_common.h
$(CC) -c FT_VNA.c
FT_ProductPAO.o: FT_ProductPAO.c openmx_common.h
$(CC) -c FT_ProductPAO.c
#
#
#
Divide_Conquer.o: Divide_Conquer.c openmx_common.h
$(CC) -c Divide_Conquer.c
Divide_Conquer_Dosout.o: Divide_Conquer_Dosout.c openmx_common.h
$(CC) -c Divide_Conquer_Dosout.c
Krylov.o: Krylov.c openmx_common.h
$(CC) -c Krylov.c
EC.o: EC.c openmx_common.h
$(CC) -c EC.c
#
#
#
MD_pac.o: MD_pac.c openmx_common.h lapack_prototypes.h
$(CC) -c MD_pac.c
#
#
#
iterout.o: iterout.c openmx_common.h
$(CC) -c iterout.c
iterout_md.o: iterout_md.c openmx_common.h
$(CC) -c iterout_md.c
Allocate_Arrays.o: Allocate_Arrays.c openmx_common.h
$(CC) -c Allocate_Arrays.c
Free_Arrays.o: Free_Arrays.c openmx_common.h
$(CC) -c Free_Arrays.c
Init_List_YOUSO.o: Init_List_YOUSO.c openmx_common.h
$(CC) -c Init_List_YOUSO.c
outputfile1.o: outputfile1.c openmx_common.h
$(CC) -c outputfile1.c
malloc_multidimarray.o: malloc_multidimarray.c
$(CC) -c malloc_multidimarray.c
PrintMemory.o: PrintMemory.c
$(CC) -c PrintMemory.c
PrintMemory_Fix.o: PrintMemory_Fix.c openmx_common.h
$(CC) -c PrintMemory_Fix.c
dtime.o: dtime.c
$(CC) -c dtime.c
OutData.o: OutData.c openmx_common.h
$(CC) -c OutData.c
OutData_Binary.o: OutData_Binary.c openmx_common.h
$(CC) -c OutData_Binary.c
init_alloc_first.o: init_alloc_first.c openmx_common.h
$(CC) -c init_alloc_first.c
File_CntCoes.o: File_CntCoes.c openmx_common.h
$(CC) -c File_CntCoes.c
SCF2File.o: SCF2File.c openmx_common.h
$(CC) -c SCF2File.c
Cutoff.o: Cutoff.c openmx_common.h
$(CC) -c Cutoff.c
Voronoi_Charge.o: Voronoi_Charge.c openmx_common.h
$(CC) -c Voronoi_Charge.c
Voronoi_Orbital_Moment.o: Voronoi_Orbital_Moment.c openmx_common.h
$(CC) -c Voronoi_Orbital_Moment.c
Fuzzy_Weight.o: Fuzzy_Weight.c openmx_common.h
$(CC) -c Fuzzy_Weight.c
dampingF.o: dampingF.c openmx_common.h
$(CC) -c dampingF.c
deri_dampingF.o: deri_dampingF.c openmx_common.h
$(CC) -c deri_dampingF.c
Spherical_Bessel.o: Spherical_Bessel.c openmx_common.h
$(CC) -c Spherical_Bessel.c
Generating_MP_Special_Kpt.o: Generating_MP_Special_Kpt.c openmx_common.h
$(CC) -c Generating_MP_Special_Kpt.c
Generate_Wannier.o: Generate_Wannier.c openmx_common.h
$(CC) -c Generate_Wannier.c
DFTDvdW_init.o: DFTDvdW_init.c openmx_common.h
$(CC) -c DFTDvdW_init.c
DFTD3vdW_init.o: DFTD3vdW_init.c openmx_common.h
$(CC) -c DFTD3vdW_init.c
neb.o: neb.c openmx_common.h Inputtools.h lapack_prototypes.h
$(CC) -c neb.c
neb_run.o: neb_run.c openmx_common.h
$(CC) -c neb_run.c
neb_check.o: neb_check.c openmx_common.h Inputtools.h
$(CC) -c neb_check.c
cellopt.o: cellopt.c openmx_common.h
$(CC) -c cellopt.c
NBO_Cluster.o: NBO_Cluster.c openmx_common.h Inputtools.h
$(CC) -c NBO_Cluster.c
NBO_Krylov.o: NBO_Krylov.c openmx_common.h Inputtools.h
$(CC) -c NBO_Krylov.c
#
#
#
mimic_sse.o: mimic_sse.c mimic_sse.h
$(CC) -c mimic_sse.c
Make_Comm_Worlds.o: Make_Comm_Worlds.c
$(CC) -c Make_Comm_Worlds.c
Set_Allocate_Atom2CPU.o: Set_Allocate_Atom2CPU.c openmx_common.h
$(CC) -c Set_Allocate_Atom2CPU.c
#
#
# Maketest, Runtest, Memory_Leak_test, Force_test, Show_DFT_DATA
#
#
Maketest.o: Maketest.c openmx_common.h Inputtools.h
$(CC) -c Maketest.c
Runtest.o: Runtest.c openmx_common.h Inputtools.h
$(CC) -c Runtest.c
Memory_Leak_test.o: Memory_Leak_test.c openmx_common.h Inputtools.h
$(CC) -c Memory_Leak_test.c
Force_test.o: Force_test.c openmx_common.h Inputtools.h
$(CC) -c Force_test.c
Stress_test.o: Stress_test.c openmx_common.h Inputtools.h
$(CC) -c Stress_test.c
Show_DFT_DATA.o: Show_DFT_DATA.c openmx_common.h Inputtools.h
$(CC) -c Show_DFT_DATA.c
#
# install
#
#
install: $(PROG)
strip $(PROG)
cp $(PROG) $(DESTDIR)/$(PROG)
#
#
# clean executable and object files
#
#
clean:
rm -f $(PROG) $(OBJS) $(UTIL) *.o elpa1.mod
#
#
# programs for generating DOS from files *.Dos.val and *.Dos.vec
#
#
DosMain: DosMain.o Inputtools.o malloc_multidimarray.o Tetrahedron_Blochl.o
$(CC) -o $@ DosMain.o Inputtools.o malloc_multidimarray.o Tetrahedron_Blochl.o -lm
cp DosMain $(DESTDIR)/DosMain
DosMain.o :DosMain.c openmx_common.h
$(CC) -o $@ -c DosMain.c
Tetrahedron_Blochl.o : Tetrahedron_Blochl.c
$(CC) -o $@ -c Tetrahedron_Blochl.c
#
#
# exchange interaction coupling constant J between two atoms
#
#
jx: jx.o read_scfout.o Eigen_lapack.o
$(CC) jx.o read_scfout.o $(LIB) -lm -o jx
cp jx $(DESTDIR)/jx
jx.o: jx.c read_scfout.h
$(CC) -c jx.c
#
#
# analysis_example
#
#
analysis_example: analysis_example.o read_scfout.o
$(CC) analysis_example.o read_scfout.o $(LIB) -lm -o analysis_example
cp analysis_example $(DESTDIR)/analysis_example
analysis_example.o: analysis_example.c read_scfout.h
$(CC) -c analysis_example.c
read_scfout.o: read_scfout.c read_scfout.h
$(CC) -c read_scfout.c
#
#
# program for generating EPS from files *.out and *.vhart
#
#
OBJS_ESP = esp.o Inputtools.o
esp: $(OBJS_ESP)
$(CC) $(OBJS_ESP) $(LIB) -lm -o $@
cp esp $(DESTDIR)/esp
esp.o : esp.c Inputtools.h
$(CC) -o $@ -c esp.c
#
#
# check_lead
#
#
check_lead: check_lead.o Inputtools.o
$(CC) check_lead.o Inputtools.o -lm -o check_lead
cp check_lead $(DESTDIR)/check_lead
check_lead.o: check_lead.c Inputtools.h
$(CC) -c check_lead.c
#
#
# optical conductivity
#
#
OpticalConductivityMain: OpticalConductivityMain.o \
Inputtools.o malloc_multidimarray.o
$(CC) -o $@ OpticalConductivityMain.o Inputtools.o malloc_multidimarray.o -lm
cp OpticalConductivityMain $(DESTDIR)/OpticalConductivityMain
#
#
# electric polarization using Berry's phase
#
#
OBJS_polB = polB.o read_scfout.o
polB: $(OBJS_polB)
$(CC) $(OBJS_polB) $(LIB) -lm -o polB
cp polB $(DESTDIR)/polB
polB.o: polB.c read_scfout.h
$(CC) -c polB.c
#
#
# test_mpi
#
#
test_mpi: test_mpi.o
$(CC) test_mpi.o $(LIB) -lm -o test_mpi
cp test_mpi $(DESTDIR)/test_mpi
test_mpi.o: test_mpi.c
$(CC) -c test_mpi.c
MAIN_TRAN_Display_Gridvalue: MAIN_TRAN_Display_Gridvalue.o TRAN_Read.o TRAN_Print.o
$(CC) -o $@ MAIN_TRAN_Display_Gridvalue.o TRAN_Read.o TRAN_Print.o -lm $(LIB)
TRAN_Main_Analysis.o: TRAN_Main_Analysis.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Main_Analysis.c
TRAN_Main_Analysis_NC.o: TRAN_Main_Analysis_NC.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Main_Analysis_NC.c
TRAN_Allocate.o: TRAN_Allocate.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Allocate.c
TRAN_Calc_GridBound.o: TRAN_Calc_GridBound.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Calc_GridBound.c
TRAN_DFT.o: TRAN_DFT.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_DFT.c
TRAN_DFT_Dosout.o: TRAN_DFT_Dosout.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_DFT_Dosout.c
TRAN_Input_std.o: TRAN_Input_std.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Input_std.c
TRAN_Input_std_Atoms.o: TRAN_Input_std_Atoms.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Input_std_Atoms.c
TRAN_Output_HKS.o: TRAN_Output_HKS.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Output_HKS.c
TRAN_Output_Trans_HS.o: TRAN_Output_Trans_HS.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Output_Trans_HS.c
TRAN_Add_Density_Lead.o: TRAN_Add_Density_Lead.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Add_Density_Lead.c
TRAN_Add_ADensity_Lead.o: TRAN_Add_ADensity_Lead.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Add_ADensity_Lead.c
TRAN_Poisson.o: TRAN_Poisson.c tran_variables.h tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Poisson.c
TRAN_RestartFile.o: TRAN_RestartFile.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_RestartFile.c
TRAN_Set_CentOverlap.o: TRAN_Set_CentOverlap.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Set_CentOverlap.c
TRAN_Set_Electrode_Grid.o: tran_variables.h tran_prototypes.h openmx_common.h
$(CC) -c TRAN_Set_Electrode_Grid.c
TRAN_Set_IntegPath.o: TRAN_Set_IntegPath.c tran_variables.h tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Set_IntegPath.c
TRAN_Set_SurfOverlap.o: TRAN_Set_SurfOverlap.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Set_SurfOverlap.c
TRAN_adjust_Ngrid.o: TRAN_adjust_Ngrid.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_adjust_Ngrid.c
Lapack_LU_inverse.o: Lapack_LU_inverse.c tran_prototypes.h lapack_prototypes.h
$(CC) -c Lapack_LU_inverse.c
TRAN_Deallocate_Electrode_Grid.o: TRAN_Deallocate_Electrode_Grid.c tran_variables.h
$(CC) -c TRAN_Deallocate_Electrode_Grid.c
TRAN_Deallocate_RestartFile.o: TRAN_Deallocate_RestartFile.c tran_variables.h
$(CC) -c TRAN_Deallocate_RestartFile.c
TRAN_Apply_Bias2e.o: TRAN_Apply_Bias2e.c tran_prototypes.h
$(CC) -c TRAN_Apply_Bias2e.c
TRAN_Calc_CentGreen.o: TRAN_Calc_CentGreen.c tran_prototypes.h
$(CC) -c TRAN_Calc_CentGreen.c
TRAN_Calc_CentGreenLesser.o: TRAN_Calc_CentGreenLesser.c tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Calc_CentGreenLesser.c
TRAN_Calc_OneTransmission.o: TRAN_Calc_OneTransmission.c tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Calc_OneTransmission.c
TRAN_Calc_SelfEnergy.o: TRAN_Calc_SelfEnergy.c tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Calc_SelfEnergy.c
TRAN_Calc_SurfGreen.o: TRAN_Calc_SurfGreen.c tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Calc_SurfGreen.c
TRAN_Calc_Hopping_G.o: TRAN_Calc_Hopping_G.c tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Calc_Hopping_G.c
TRAN_Credit.o: TRAN_Credit.c tran_prototypes.h
$(CC) -c TRAN_Credit.c
TRAN_Output_HKS_Write_Grid.o: TRAN_Output_HKS_Write_Grid.c tran_prototypes.h
$(CC) -c TRAN_Output_HKS_Write_Grid.c
TRAN_Print.o: TRAN_Print.c tran_prototypes.h
$(CC) -c TRAN_Print.c
TRAN_Print_Grid.o: TRAN_Print_Grid.c tran_prototypes.h
$(CC) -c TRAN_Print_Grid.c
TRAN_Read.o: TRAN_Read.c tran_prototypes.h
$(CC) -c TRAN_Read.c
TRAN_Set_Value.o: TRAN_Set_Value.c tran_prototypes.h
$(CC) -c TRAN_Set_Value.c
TRAN_Check_Region_Lead.o: TRAN_Check_Region_Lead.c tran_variables.h
$(CC) -c TRAN_Check_Region_Lead.c
TRAN_Check_Region.o: TRAN_Check_Region.c tran_prototypes.h
$(CC) -c TRAN_Check_Region.c
TRAN_Check_Input.o: TRAN_Check_Input.c tran_prototypes.h
$(CC) -c TRAN_Check_Input.c
TRAN_Set_MP.o: TRAN_Set_MP.c
$(CC) -c TRAN_Set_MP.c
TRAN_Distribute_Node.o: TRAN_Distribute_Node.c
$(CC) -c TRAN_Distribute_Node.c
TRAN_Allocate_NC.o: TRAN_Allocate_NC.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Allocate_NC.c
TRAN_DFT_NC.o: TRAN_DFT_NC.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_DFT_NC.c
TRAN_Set_CentOverlap_NC.o: TRAN_Set_CentOverlap_NC.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Set_CentOverlap_NC.c
TRAN_Set_SurfOverlap_NC.o: TRAN_Set_SurfOverlap_NC.c tran_variables.h tran_prototypes.h
$(CC) -c TRAN_Set_SurfOverlap_NC.c
# S MitsuakiKAWAMURA
MTRAN_EigenChannel.o: MTRAN_EigenChannel.c tran_prototypes.h \
TRAN_Calc_SurfGreen.o TRAN_Calc_SelfEnergy.o TRAN_Calc_CentGreen.o
$(CC) -c MTRAN_EigenChannel.c
TRAN_Channel_Functions.o: TRAN_Channel_Functions.c lapack_prototypes.h
$(CC) -c TRAN_Channel_Functions.c
TRAN_Channel_Output.o: TRAN_Channel_Output.c openmx_common.h
$(CC) -c TRAN_Channel_Output.c
TRAN_Calc_CurrentDensity.o: TRAN_Calc_CurrentDensity.c tran_prototypes.h lapack_prototypes.h
$(CC) -c TRAN_Calc_CurrentDensity.c
TRAN_CDen_Main.o: TRAN_CDen_Main.c openmx_common.h lapack_prototypes.h tran_prototypes.h tran_variables.h
$(CC) -c TRAN_CDen_Main.c
# E MitsuakiKAWAMURA
elpa1.o: elpa1.f90
$(FC) -c elpa1.f90
solve_evp_real.o: solve_evp_real.f90
$(FC) -c solve_evp_real.f90
solve_evp_complex.o: solve_evp_complex.f90
$(FC) -c solve_evp_complex.f90
#
#
# bandgnu13
#
#
bandgnu13: bandgnu13.c
gcc bandgnu13.c -lm -o bandgnu13
bin2txt: bin2txt.c
gcc bin2txt.c -lm -o bin2txt
cube2xsf: cube2xsf.c
gcc cube2xsf.c -lm -o cube2xsf
intensity_map: intensity_map.c
gcc intensity_map.c -lm -o intensity_map
md2axsf: md2axsf.c
gcc md2axsf.c -lm -o md2axsf
