Hi, I've been running an input file on my single processor system successfully but when I try running it from QE installed on High Performance Cluster in my institute, it gives the following error :- *Error in routine read_input (2):* * opening input file* The complete output is :-
* Parallel version (MPI), running on 50 processors* * R & G space division: proc/nbgrp/npool/nimage = 50* *Open_input_file: error opening way.in <http://way.in>* * Error in routine read_input (2):* * opening input file* * stopping ...* Input file :- *&CONTROL* * calculation = 'scf' ,* * pseudo_dir = '/home/rocke/Desktop/pps/' ,* * /* * &SYSTEM* * ibrav = 2,* * celldm(1) = 3.52,* * nat = 1,* * ntyp = 1,* * ecutwfc = 20 ,* * /* * &ELECTRONS* * mixing_beta = 0.7 ,* * diagonalization = 'cg' ,* * /* *ATOMIC_SPECIES* * Ni 58.69340 Ni.pz-hgh.UPF * *ATOMIC_POSITIONS alat * * Ni 14.934095219 4.978031740 10.000000000 * *K_POINTS automatic * * 6 6 6 0 0 0 * Thank You. Vishal Gupta B.Tech. 2nd year Mechanical IIT Ropar Email :- [email protected]
_______________________________________________ Pw_forum mailing list [email protected] http://pwscf.org/mailman/listinfo/pw_forum
