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August 23, 2019

Gamess error finding MCP data files Log Out | Topics | Search
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WebMO Support Forum » Running WebMO Jobs » Job Options » Gamess error finding MCP data files « Previous Next »

Author Message
Randy Miller
Unregistered guest
Posted on Sunday, December 07, 2008 - 10:24 am:   

I am trying to use MCP basis sets. I set PP=MCP in the $control group and GBASIS=mcp-dzp in the $basis group. I get an error that the external cannot be found. Now if I submit this same job from the command line using rungms it runs just fine.
JR Schmidt
Moderator
Username: Schmidt

Post Number: 61
Registered: 11-2006
Posted on Sunday, December 07, 2008 - 2:18 pm:   

Add the line:
$ENV{'MCPPATH'} = "$gamessGMSPATH/mcpdata";

to run_gamess.cgi, right after the similar line for ERICFMT, etc.
Randy Miller
Unregistered guest
Posted on Sunday, December 07, 2008 - 2:44 pm:   

That did it!! thanks JR

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