[Wien] Error with new update

Gavin Abo gsabo at crimson.ua.edu
Sat Jun 6 00:10:21 CEST 2015


After looking at the error message more closely, it looks like the error 
is caused because dstart of WIEN2k 13.1 was used instead of dstart of 
14.2. So it looks like you still need to update the dstart package from 
WIEN2k 13.1 to 14.2.  To avoid conflicts, you might want to remove all 
previous WIEN2k installations and then install WIEN2k 14.2 again.

On 6/5/2015 1:19 PM, Peter Blaha wrote:
> I'd expect there is another error during initialization before.
>
> a) Try some other simple examples. Does it happen always ?
>
> b) The case.in0 file is ok before dstart is running (it is the same as 
> case.in0_st) and only dstart should add additional data to it (writing 
> case.in0_std.
>
>
> Am 05.06.2015 um 17:47 schrieb B Tankhilsaihan:
>> Hello Dear Peter Blaha and Wien2k Users
>> I was running in Wien2k_13.1 then few days ago I updated to 14.2.
>> I downloaded full package and installed it by following instruction.
>> But unfortunately I got error with "x dstart" when I do initialization.
>>
>> forrtl: severe (24): end-of-file during read, unit 14, file 
>> /home/wgfkp/WIEN2k/c-mini/c-mini.in0
>> Image              PC                Routine Line        Source
>> dstart             0000000000455C26  Unknown Unknown  Unknown
>> dstart             00000000004108D6  make_inter_ 35  make_inter.F
>> dstart             000000000040D988  MAIN__ 21  dstart.F
>> dstart             0000000000402ED6  Unknown Unknown  Unknown
>> libc.so.6          00002B03237DDA40  Unknown Unknown  Unknown
>> dstart             0000000000402DC9  Unknown Unknown  Unknown
>> 3.4u 0.1s 0:03.98 88.9% 0+0k 16232+13128io 45pf+0w
>> error: command   /home/wgfkp/wien2k/dstart dstart.def   failed
>>
>> Then I checked case.in0 file but it is incomplete.
>> It shows only following lines
>>
>>
>> TOT  XC_PBE     (XC_LDA,XC_PBESOL,XC_WC,XC_MBJ,XC_REVTPSS)
>> NR2V
>>
>> I asked it previously and got respond from Gavin Abo. He said that it is
>> maybe because of format diffrence between old and new version.
>> If so how can I fix it?
>> Thanks in advance
>>
>> Regards
>> Batsaikhan.T


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