Hello,
I am trying to run a calculation on mos2 unit cell. I am getting an error
There is a problem with the input file : maybe
a disagreement between the declared dimension of the array,
and the number of data actually provided.
Action: correct your input file !
src_file: inarray.F90
src_line: 190
I could not find the source of the error.
Can anyone point me out what may be the problem
Attached is my input file
Regards
Soumyajyoti
dimension mismatch [SOLVED]
Moderator: bguster
dimension mismatch
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mos2.in- (2.38 KiB) Downloaded 418 times
Soumyajyoti Haldar
Ph.D student, Uppsala University
Inst. f Fysik O Astronomi, Materialteori
Box 516, SE - 751 20
Uppsala, Sweden
Ph.D student, Uppsala University
Inst. f Fysik O Astronomi, Materialteori
Box 516, SE - 751 20
Uppsala, Sweden
dimension mismatch
How to construct a super cell using abinit?
I am trying to build a super cell for ZnO and TiO2 using input variables, natrd =2 , nobj = 1 , nobjaat = 1 2 abjaat = 2 2 1 (for 2*2*1 super cell). But, at the time of compilation it is giving error mentioning array is not correct... Can any one tell me whether I am using correct variables and their values ?
I am trying to build a super cell for ZnO and TiO2 using input variables, natrd =2 , nobj = 1 , nobjaat = 1 2 abjaat = 2 2 1 (for 2*2*1 super cell). But, at the time of compilation it is giving error mentioning array is not correct... Can any one tell me whether I am using correct variables and their values ?
Re: dimension mismatch [SOLVED]
You can find more information about the error earlier in the output. You can see something like:
inarray :
An error occurred reading data for keyword " ACELL",
looking for 3 array elements.
You should set acell 3*1.000000, but I think there is also something wrong with your rprim.
Julia
inarray :
An error occurred reading data for keyword " ACELL",
looking for 3 array elements.
You should set acell 3*1.000000, but I think there is also something wrong with your rprim.
Julia