[molpro-user] bug in ddr ?

[Andy May]

Chun-Woo,

There is no 12.0.2 version of Molpro, do you mean 2012.1.0 version of 
Molpro, or in fact 12.0.2 version of the Intel compiler?

If you can send the output and CONFIG file I'll take a look. For Intel 
13 compiler it is necessary to deoptimize musamc.F to level 2, but this 
should be automatic if using the nightly build with latest updates.

Best wishes,

Andy

On 01/04/13 01:04, 이천우 wrote:
> Dear molpro user,  I run the example file in
> http://www.molpro.net/info/current/examples/lif_nacme.com. But the
> result is different from the one in p305. If I look into the output
> file, I found the error message VARIABLE NACME UNDEFINED, ASSUMING 0
> after the part of two-point formula. Is this a bug in the version of
> molpro 12.0.*2 I* use ?
>
> Sincerely yours, Chun-Woo Lee
>
>
>
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