Thanks Paolo.
One more thing I noticed that,if I turn off the LSD it doesn't show the
error, it is only showing error with LSD and since I am having transition
metal system I need an open shell calculation.
Thank you
Regards
Rahul
> Just change the format from (a,2f12.8,/,a,2f12.8) to (a,f12.8,
Just change the format from (a,2f12.8,/,a,2f12.8) to (a,f12.8,/,a,f12.8)
Paolo
On Fri, Aug 27, 2021 at 3:06 PM wrote:
> Hello,
>
> I am trying to perform CP dynamics of magnetic system but I am getting an
> format error from a subroutine chargedensity.f90. Below the exact error
> message :
>
>
Hello,
I am trying to perform CP dynamics of magnetic system but I am getting an
format error from a subroutine chargedensity.f90. Below the exact error
message :
At line 1079 of file chargedensity.f90 (unit = 6, file = 'stdout')
Fortran runtime error: Expected REAL for item 3 in formatted trans
