[molpro-user] No convergence in CP-MCSCF

[Rameswar Bhattacharjee]

Dear all molpro users,

I am using CP-MCSCF for non-adiabatic coupling.But I am getting an error
like following

----------------------------------------------------------------------
 ** WVFN ****  CONVERGENCE REACHED, FINAL GRADIENT:  0.53D-06

 SOLVING CP-MCSCF NACM: 2.1 - 1.1

 NO CONVERGENCE OF CP-MCSCF AFTER900 ITEATIONS AND 9 RESTARTS; FINAL
ACTEST=  0.53D+00
-------------------------------------------------------------------------------------------------

Any suggestion concerning how can I converge my job would be highly
appreciated.Thank you.

Regards
RAmeswar



-- 
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*"The man who makes no mistakes does not usually make anything."*
*                                  Edward John Phelps (1822-1900)*
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Rameswar Bhattacharjee
Junior Research Fellow
Dept. of Spectroscopy
Indian Association for the Cultivation of Science
Jadavpur, Kolkata-32
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