Dear All, In this error : no output is generated in si.bands.david.out & no other output files is generated i.e si.band.cg.out etc.. I think because in run_example file no command has been given to run bands.x to perform band structure calculation so after this line # how to run executables in the run_example file ,I appended bands.x to run band structure calculations
PW_COMMAND="$PARA_PREFIX $BIN_DIR/pw.x $PARA_POSTFIX" PW_COMMAND="$PARA_PREFIX $BIN_DIR/bands.x $PARA_POSTFIX" <------- After this ,I run the code then all files were generated like in reference folder , all input files are ok but all output files are having namelist error and error file have one more error MPI ABORT process 0 I dont know how to introduce bands.x correctly in the run_example so it would do calculations for bands also and generate files similar to reference folder. please help....I am sorry if it is very trivial ..:( Thanks Priya Shrivastava Phd student Indian Institute of Technology,Bombay India -------------- next part -------------- An HTML attachment was scrubbed... URL: http://pwscf.org/pipermail/pw_forum/attachments/20140314/c7637e5d/attachment.html
