From NWChem
Viewed 175 times, With a total of 1 Posts
|
Clicked A Few Times
Threads 3
Posts 5
|
|
3:41:52 PM PDT - Fri, Mar 27th 2015 |
|
Hi,
I am trying to calculate the HOMO and LUMO energy levels for polmeric cation. I am getting below error:-
movecs_read_header: failed to open etmepyro1.movecs IERR = 1
DPlot: movecs_read_header failed 1
DPlot: movecs_read_header failed 1
------------------------------------------------------------------------
------------------------------------------------------------------------
current input line : DPlot: movecs_read_header failed 1
------------------------------------------------------------------------
------------------------------------------------------------------------
current input line : DPlot: movecs_read_header failed 1
------------------------------------------------------------------------
------------------------------------------------------------------------ DPlot: movecs_read_header failed 1
------------------------------------------------------------------------
------------------------------------------------------------------------
current input line :
0:
Kindly let me know what i need to do to resolve it.
|
|
|
-
Edoapra Forum:Admin, Forum:Mod, bureaucrat, sysop
|
|
Forum Vet
Threads 3
Posts 855
|
|
9:27:49 AM PDT - Mon, Mar 30th 2015 |
|
Aniruddha
Could you post your input file?
|
|
|
AWC's:
2.5.10 MediaWiki - Stand Alone Forum Extension
Forum theme style by: AWC