If you run a parallel calculation, you must first lunch the command: gather_energy.pl
2017-07-21 3:35 GMT+02:00 Lagoun brahim <b.lag...@lagh-univ.dz>: > hallo every one > > i am doing a transport properties calculation with (wien2k14.2+BoltzTraP > 1.2.5) code but when i execute: x_trans BoltzTrP with or without the flags: > (-up or -dn or -so) i have the following error message: > x_trans BoltzTraP > ================ BoltzTraP vs 1.2.5 ============= > LiFePO42 > > XXXXXXXX > forrtl: severe (24): end-of-file during read, unit 48, file > /home/LiFePO42/LiFePO42.engre > Image PC Routine Line > Source > BoltzTraP 000000000058BFBA Unknown Unknown Unknown > BoltzTraP 000000000058AB35 Unknown Unknown Unknown > BoltzTraP 00000000004BAC26 Unknown Unknown Unknown > BoltzTraP 00000000004776E6 Unknown Unknown Unknown > BoltzTraP 0000000000476E59 Unknown Unknown Unknown > BoltzTraP 0000000000497EA4 Unknown Unknown Unknown > BoltzTraP 00000000004084C3 bandstructure_mp_ 133 > m_bandstructure.F90 > BoltzTraP 00000000004126DA MAIN__ 266 > BoltzTraP.F90 > BoltzTraP 0000000000404A5C Unknown Unknown Unknown > libc.so.6 00002AC5C7439B05 Unknown Unknown Unknown > BoltzTraP 0000000000404959 Unknown Unknown Unknown > 0.019u 0.006s 0:00.02 50.0% 0+0k 0+8io 0pf+0w > > > i use ifort compiler + mkl libraries (the same think when i compile the > code with gfortran compiler with blas and lapack) > any suggestion > the tests work very well > thank you in advance > > _______________________________________________ > Wien mailing list > Wien@zeus.theochem.tuwien.ac.at > http://zeus.theochem.tuwien.ac.at/mailman/listinfo/wien > SEARCH the MAILING-LIST at: http://www.mail-archive.com/ > wien@zeus.theochem.tuwien.ac.at/index.html > >
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