[Pw_forum] BAND STRUCTURE CAL SHOWS ERROR

Ridwan Agbaoye agbaoyeridwan at yahoo.com
Fri May 6 13:02:26 CEST 2016


I guess you are using pw.x instead of bands.x for your calculation thats the reason for your error,  your input is good enough use bin/band.x for the calculation 

    On Thursday, May 5, 2016 1:23 PM, Manu Hegde <mhegde at uwaterloo.ca> wrote:
 

 I might be wrong but just try .dat instead of dat1. It might work.

On Thu, May 5, 2016 at 1:15 PM, Raj kamal <rajkamalloyola at gmail.com> wrote:


​DEAR QE experts this is my error when i try to calculate bands.x calculation in quantum espresso 5.3.0   task #         0     from bands : error #         1     reading bands namelistmy input........&BANDS outdir = '/home/ran/espresso-5.3.0/temp/' ,                 prefix = 'RGOvcd3scf' ,filband= 'bands.dat1',/​​please suggest me ...to rectify this problem.thanks in advance.​
-- 
Best regards,Rajkamal.A.Research Scholar,(SRM UNIV).
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