NLO and usepaw=1

antonio · Post by **antonio** » Mon Jun 17, 2013 5:17 pm

Dear all,

I'm using abinit 7.2. I'm trying to do an NLO calculation using paw datasets and I get the following error:

chkinp: Checking input parameters for consistency, jdtset= 5.

chkint_prt: ERROR -
Context : the value of the variable usepaw is 1.
The value of the input variable optdriver is 5, while it must be
equal to one of the following: 0 1 3 4 8 99
Action : you should change the input variables optdriver or usepaw.

Is the problem related to the fact that optdriver = 5 is not compatible with PAW datasets yet?

Thanks a lot in advance for your kind help

Best

Antonio

jzwanzig · Post by **jzwanzig** » Fri Jun 21, 2013 12:25 pm

Yes, NLO has not been coded for PAW.

antonio · Post by **antonio** » Fri Jun 21, 2013 4:39 pm

OK, thanks a lot for your kind reply.

Best

Antonio

charlesdarnay · Post by **charlesdarnay** » Fri Apr 17, 2015 7:02 pm

Hi,

I think I have a similar question. I get the message:

Context : the value of the variable optdriver is 1.
Context : the value of the variable usepaw is 1.
The value of the input variable ieig2rf is 1, while it must be
equal to 0

Does that mean I can't use ieig2rf if I'm using PAW?

Regards,
Jean Paul

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NLO and usepaw=1 [SOLVED]

NLO and usepaw=1

Re: NLO and usepaw=1 [SOLVED]

Re: NLO and usepaw=1

Re: NLO and usepaw=1