[Wien] Error in LAPW2

Riyajul Islam riyajul80 at gmail.com
Mon Jan 27 10:41:00 CET 2020


Dear Prof. Peter Blaha,
I am running SCF calculation of a ferrite compound in parallel mode.
While lapw1 runs fine but the job terminates with an error in Lapw2 as

**  LAPW2 crashed!
0.1u 0.0s 0:00.13 107.6% 0+0k 0+128io 0pf+0w
error: command   /home/physics/Wien2k_19.1/lapw2para -up uplapw2.def   failed

>   stop error

The *uplapw2.error* file contains this

'LAPW2' - can't open unit: 30
 'LAPW2' -        filename: Fe3O4.energyup_1
**  testerror: Error in Parallel LAPW2


Kindly suggest me some solution for this issue.


With regards

-- 
Riyajul Islam
Ph.D Scholar
National Institute of Technology Nagaland
Chumukedima, Dimapur
Nagaland 797103, India
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