ADC(3) Input

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FM

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Mar 17, 2021, 5:17:06 AMMar 17
to dirac-users
Dear Dirac users,
I would like to ask about the new input for the ADC(3). I have tried run a test calculation (non-relativistic) on thiophene according to the following format.

**DIRAC
.WAVE FUNCTION
**HAMILTONIAN
.NONREL
**WAVE FUNCTIONS
.SCF
.RELADC
**MOLECULE
*BASIS
.DEFAULT
cc-pVTZ
*END OF INPUT
 $RELADC DOSIPS=T, ADCLEVEL=3, XREPS=1,2,3,4 VCONV=1.0D-05 $END
 $LANINP SIPITER=1000, SIPPRNT=25.0 $END 

This is the old format (dirac 2011). When I tried on dirac 2019 the calculation is running, but I cannot get the ADC(3) output.

Can someone suggest how to change the input?

Thanks a lot for your help 

Kind Regards

FM
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