I'm sorry I have a mistake in last reply. The detail of iput file of plotproj.x should be:
! The input of this program is: ! filename ! name of the file with the band eigenvalues ! filename1 ! name of the file with the projections ! fileout ! name of the output file where the bands are written ! threshold ! see below ! ncri ! number of criterions for selecting the bands ! for each criterion ! first_atomic_wfc, last_atomic_wfc ! the band is selected if the ! sum of the projections on ! the atomic wavefunctions between ! first_atomic_wfc and ! last_atomic_wfc is larger than ! threshold. The sum is done on ! all criterions. ! you can read in: PP/plotproj.f90 Best regards, Linh >> Hi, >> >> Could some one give me a example input for the plotproj.x program. > > You can see the details of input file in: > http://www.quantum-espresso.org/input-syntax/INPUT_PP.html > > > Here is an example of my input file run by pp.x for plot_num =11 > > &inputPP > prefix='pureCu_111', > outdir='$TMP_DIR2', > plot_num=11 > filplot = 'wf_Cu' > / > &plot > iflag=3, > output_format=3 > nx =50, ny=50, nz=50 > / > > > Good luck, > > Linh > > > ----------------------------------------------------- > Nguyen Ngoc Linh, PhD Student > c/o: SISSA & CNR-INFM Democritos, > via Beirut 2-4, 34014 Trieste (Italy) > email: nnlinh at sissa.it > phone: +39 04 03787 319 > skype: ngoclinh84phys > ----------------------------------------------------- > "The physics is theoretical but the fun is real" > > > ---------------------------------------------------------------- > SISSA Webmail https://webmail.sissa.it/ > Powered by SquirrelMail http://www.squirrelmail.org/ > > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://www.democritos.it/mailman/listinfo/pw_forum > ----------------------------------------------------- Nguyen Ngoc Linh, PhD Student c/o: SISSA & CNR-INFM Democritos, via Beirut 2-4, 34014 Trieste (Italy) email: nnlinh at sissa.it phone: +39 04 03787 319 skype: ngoclinh84phys ----------------------------------------------------- "The physics is theoretical but the fun is real" ---------------------------------------------------------------- SISSA Webmail https://webmail.sissa.it/ Powered by SquirrelMail http://www.squirrelmail.org/
