[DFTB-Plus-User] Compilation Problem

[debs at iitk.ac.in]

Hi,
 I am new with DFTB+ and I am trying to install it in my Ubuntu 12.04 OS.
I am getting some error which I can not able to sort out. I am using
make.x86_64-linux-gfortran file. I have modified the make file and it is
given below.


# -*- makefile -*-
############################################################################
# System dependent Makefile options for
# Linux, gfortran (4.4.3) + Atlas (3.6.0)
############################################################################

# Fortran 90 compiler
FC90 = gfortran

# Options for the Fortran 90 compiler
FC90OPT = -O2 -openmp -funroll-all-loops -fall-intrinsics

# Preprocessor (leave empty, if the compiler has a built in preprocessor)
CPP = cpp -traditional

# Options for preprocessing
CPPOPT = -DDEBUG=$(DEBUG) #-DEXTERNALERFC

# Postprocessing of the preprocessor output (add-on pipe)
CPPPOST = $(ROOT)/utils/fpp/fpp.sh general

# Linker
LN = $(FC90)

# Linker options
LNOPT = -static

# Override options for different DEBUG modes
ifeq ($(DEBUG),1)
    FC90OPT = -g -Wall -std=f2003 -pedantic -fall-intrinsics -fbounds-check
endif
ifeq ($(DEBUG),2)
    FC90OPT = -g -Wall -std=f2003 -pedantic -fall-intrinsics -fbounds-check
endif
ifeq ($(DEBUG),3)
    FC90OPT = -g -Wall -std=f2003 -pedantic -fall-intrinsics -fbounds-check
endif

# Library options in general
ATLASDIR = /usr/lib
LIBOPT = -L$(ATLASDIR)

# How to link specific libraries
LIB_LAPACK = -llapack
LIB_BLAS = -lblas
# Threaded version may work as well
# LIB_BLAS = -lptf77blas -lptcblas -latlas



The error is given below.

/usr/lib/libblas.a(xerbla.o): In function `xerbla_':
(.text+0x0): multiple definition of `xerbla_'
/usr/lib/liblapack.a(xerbla.o):(.text+0x0): first defined here
collect2: ld returned 1 exit status
make[1]: *** [dftb+] Error 1
rm disp_common.f90 qm.f90 md_integrator.f90 slako_eq_grid.f90
short_gamma.f90 sk.f90 thirdorder.f90 rep_poly.f90 nhc_thermostat.f90
geoopt.f90 tokenreader.f90 scc_init.f90 mainio.f90 intrinsicpr.f90
dftb+.f90 formatout.f90 bisection.f90 inputdata_.f90 fifo.f90 memman.f90
fact.f90 xmlutils.f90 sort.f90 md_common.f90 disp_uff.f90
type_geometry.f90 densitymatrix.f90 shift.f90 etemp.f90 hsdutils.f90
eigensolver.f90 andersen_thermostat.f90 extcharge.f90 dftb_pls_u.f90
ext_erfc.f90 spinorbit.f90 stressTensor.f90 initprogram.f90
broyden_mixer.f90 unitconversion.f90 dispersion.f90 orbital_equiv.f90
angmomentum.f90 wrapped_pointers.f90 forces.f90 linmin.f90 diis_mixer.f90
repulsive.f90 accuracy.f90 mixer_adt.f90 stringlist.f90 general_list.f90
hermite.f90 hsdparser.f90 lapackroutines.f90 old_sk_data.f90
eigenvects.f90 type_geometry_hsd.f90 berendsen_thermostat.f90
linkedlist.f90 velocity_verlet.f90 charmanip.f90 energies.f90 scc.f90
disp_slaterkirkwood.f90 potentials.f90 disp_uff_data.f90 message.f90
taggedout.f90 parser.f90 blasroutines.f90 thermostat.f90 constraints.f90
nonscc.f90 numericalDerivs.f90 populations.f90 periodic.f90 hsdutils2.f90
temp_profile.f90 oldcompat.f90 slako_cont.f90 charge_constraints.f90
simple_algebra.f90 rep_spline.f90 common_types.f90 dummy_thermostat.f90
conjgrad.f90 sparse2dense.f90 simple_mixer.f90 stepdesc.f90 rep_cont.f90
allocate.f90 fileid.f90 coulomb.f90 constants.f90 interpolation.f90
spin.f90 anderson_mixer.f90 ranlux.f90
make[1]: Leaving directory
`/home/user/Downloads/dftb+_1.2.2_src/prg_dftb/_obj_x86_64-linux-gfortran'
make: *** [_obj_x86_64-linux-gfortran] Error 2

Thanking you in anticipation.
                                  Regards
                                  Deb Sankar De