You need the mass per atom type, not per atom P.
On Dec 27, 2012, at 16:34 , Mahdi Faghih nasiri wrote: > Dear all, > I am trying to run an ph calculation but the code complains: > > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% > from phq_readin : error # 19 > reading inputph namelist > %%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%% > > I have checked input file but could not find anything wrong.: > > / > &inputph > tr2_ph=1.0d-14, > ldisp=.true., > nq1=4, nq2=4, nq3=1 > amass(1)= 12.0107 , > amass(2)= 12.0107 , > amass(3)= 12.0107 , > amass(4)= 12.0107 , > amass(5)= 12.0107 , > amass(6)= 12.0107 , > amass(7)= 12.0107 , > amass(8)= 12.0107 , > amass(9)= 12.0107 , > amass(10)= 12.0107 , > amass(11)= 12.0107 , > amass(12)= 12.0107 , > outdir='/root/Desktop/QE/out/1', > fildyn='1.dyn', > / > > > > Mahdi Faghih nasiri > MSC, > Guilan University, > Rasht, Iran. > _______________________________________________ > Pw_forum mailing list > Pw_forum at pwscf.org > http://pwscf.org/mailman/listinfo/pw_forum --- Paolo Giannozzi, Dept of Chemistry&Physics&Environment, Univ. Udine, via delle Scienze 208, 33100 Udine, Italy Phone +39-0432-558216, fax +39-0432-558222
