[Wien] dstart error in wien2k ver21_1

Ashwani Kumar ashwani.ism at gmail.com
Thu Sep 2 18:46:44 CEST 2021


Hello everyone,
    Recently, I have upgraded wien2k version (from ver19 to ver21) and OS (
ubuntu 18.04 to 20.04 LTS). I have followed the procedure as described in
thread
https://www.mail-archive.com/wien@zeus.theochem.tuwien.ac.at/msg21134.html
i am getting the error during initialization of the calculation for dstart.
 " next is dstart
>   dstart  -p > & .mist (17:12:16)
 stop error"

An empty "dstart.error" file is generated.

When dstart program is called individually with and without -p switch,
these are results.
ser at user:~/WIEN2k/STO$ x dstart -p
starting parallel dstart at Thursday 02 September 2021 05:22:41 PM IST
-------- .machine0 : 1 processors
running dstart remotely on localhost
ssh: connect to host localhost port 22: Connection refused
0.053u 0.020s 0:00.07 100.0% 0+0k 0+48io 0pf+0w
error: command   /apps/code/wien2k/dstartpara dstart.def   failed
user at user:~/WIEN2k/STO$ x dstart
STOP DSTART ENDS
1.659u 0.287s 0:00.45 428.8% 0+0k 0+600io 0pf+0w

 dstart without -p executes successfully. With -p switch, def failed.
Please help how to solve this.

Regards,
A. kumar
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