[molpro-user] (no subject)

Andy May MayAJ1 at cardiff.ac.uk
Fri Apr 13 08:01:30 BST 2012


George,

Looking at your output I can see you are not using the most recent 
version of 2010.1. Can you download and try with 2010.1.25?

If you then still have problems, please send the CONFIG file so we can 
see which compilers etc. are being used.

Best wishes,

Andy

On 13/04/12 07:39, george wrote:
> Dear Molpro developers,
>                                          I am installing molpro2010.1
> version in my laptop I am using Mandriva 2011 OS. After configuring step
> I issued make command. But it failed with the following highlighted
> error message. I dont understand where the problem lies. It would be
> nice if someone help me out.
>
> make[1]: Entering directory `/home/george/Downloads/molpro2010.1/utilities'
> building ftc.exe
> building molpro-configure
> building patcher.exe
> make[1]: Leaving directory `/home/george/Downloads/molpro2010.1/utilities'
> make[1]: Entering directory `/home/george/Downloads/molpro2010.1/src'
> Preprocessing include files
> make[2]: Entering directory `/home/george/Downloads/molpro2010.1/src/global'
> make[3]: Entering directory `/home/george/Downloads/molpro2010.1/src/global'
> make[3]: Leaving directory `/home/george/Downloads/molpro2010.1/src/global'
> make[2]: Leaving directory `/home/george/Downloads/molpro2010.1/src/global'
> make[2]: Entering directory
> `/home/george/Downloads/molpro2010.1/src/Molcas/alaska'
> Rebuilding alaska/depend
> make[3]: Entering directory
> `/home/george/Downloads/molpro2010.1/src/Molcas/alaska'
> preprocessing drvg1.F
> compiling drvg1.F
> failed
> drvg1.F:171.12:
>
>        P_Eff=Dble(nij)
>              1
> Warning: Possible change of value in conversion from REAL(16) to REAL(8)
> at (1)
> drvg1.F:237.27:
>
>        ijS = Int((One+DSqrt(Eight*TskLw-Three))/Two)
>                             1
> Error: 'x' argument of 'dsqrt' intrinsic at (1) must be double precision
> make[3]: *** [drvg1.o] Error 1
> make[3]: Target `targets' not remade because of errors.
> make[3]: Leaving directory
> `/home/george/Downloads/molpro2010.1/src/Molcas/alaska'
> make[2]: *** [default] Error 2
> make[2]: Leaving directory
> `/home/george/Downloads/molpro2010.1/src/Molcas/alaska'
> make[1]: *** [Molcas/alaska] Error 2
> make[1]: Leaving directory `/home/george/Downloads/molpro2010.1/src'
> make: *** [src] Error 2
>
>
>
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