[DFTB-Plus-User] Fwd: problem with installation

[RICCARDO ROZZA]

Dear Farzad,

It seems that you need to install the arpack library (ld: cannot find -larpack).
All the best,

Riccardo.

On 22 Jun 2019, at 10:01, Farzad Molani <f.molani at gmail.com<mailto:f.molani at gmail.com>> wrote:


Dear DFTB users,
I want to install the newest version of DFTB+. The source and executable files from http://www.dftbplus.org/download/dftb-stable/  have been downloaded and untarred. I try to install the software based on instructions on INSTALL.rst, but I got the following error after the make.
.
.
.
.
w.o dispuffdata.o inputdata.o pmlocalisation.o repcont.o repspline.o reppoly.o xlbomd.o extlagrangian.o linresp.o linrespgrad.o qm.o linrespcommon.o arpack.o eigensolver.o typegeometry.o simplemixer.o numderivs2.o potentials.o thirdorder.o charges.o dftbplusu.o geoopt.o steepdesc.o gdiis.o orbitalequiv.o broydenmixer.o stress.o etemp.o hermite.o factorial.o intrinsicpr.o mixer.o andersonmixer.o elecconstraints.o angmomentum.o eigenvects.o parser.o hsdutils2.o unitconversion.o oldcompat.o typegeometryhsd.o oldskdata.o densitymatrix.o populations.o repulsive.o spinorbit.o forces.o  -L/home/fmolani/DFTB+/dftbplus-18.2/_build/external/xmlf90 -lxmlf90  -L/home/fmolani/DFTB+/dftbplus-18.2/_build/external/fsockets -lfsockets   -L/apps/intel/2015/composer_xe_2015.3.187/mkl/lib/intel64 -lmkl_intel_lp64 -lmkl_intel_thread -lmkl_core  -larpack -liomp5
ld: cannot find -larpack
make[1]: *** [dftb+] Error 1
make[1]: Leaving directory `/home/fmolani/DFTB+/dftbplus-18.2/_build/prog/dftb+'
make: *** [dftb+] Error 2

I would appreciate to help me to solve the problem.
Best regards, Farzad
--
Farzad Molani
Postdoctoral Research Fellow
School of Pharmaceutical Science and Technology
Tianjin University
Building 24, Room A205
92 Weijin Road, Nankai District
P. R. China
Tel.: +8617526526420
Email: f.molani at gmail.com<mailto:f.molani at gmail.com> and f.molani at tju.edu.cn<mailto:fmolani at dena.kntu.ac.ir>


--
Farzad Molani
Postdoctoral Research Fellow
School of Pharmaceutical Science and Technology
Tianjin University
Building 24, Room A205
92 Weijin Road, Nankai District
P. R. China
Tel.: +8617526526420
Email: f.molani at gmail.com<mailto:f.molani at gmail.com> and f.molani at tju.edu.cn<mailto:fmolani at dena.kntu.ac.ir>
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