[molpro-user] {SPAM}? Asking your help please

[Kirk Peterson]

Dear Rana,

in order to use the results from another calculation, you need to have saved Molpro file 2  to a permanent file and use this in your current calculation. For example,
at the top of your input just below any memory directive put the following in both inputs:

file,2,myfile.wf

Unfortunately if you did not do this in your first calculation, then you will have to repeat it.

best regards,

Kirk


On Oct 22, 2011, at 10:20 AM, Rana Zahdeh wrote:

> Hi,
>  
> I need to calculate the transition dipole moment between two states saved in different record numbers. I used the following command:
>  
> {ci;trans,6030.2,6000.2;
> dm,8130.2} 
>  
> The problem is that the record 6000.2 is calculated in another output file, in the same directory where I’m doing my calculations.    
> The error that I receive is that it doesn’t find this record.
>  
> Will you please help me to know how to enable it to read this record?
>  
> Thanks in advance,
> Rana.
> _______________________________________________
> Molpro-user mailing list
> Molpro-user at molpro.net
> http://www.molpro.net/mailman/listinfo/molpro-user

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