[molpro-user] A little confused about SO chapter

[pauli]

Hi everyone:


    It is known that “HLSDIAG" can transfer to the precomputed values.If I only focus on
A ,does the following situation in Molpro make difference for Ω state of A?
1.replace all energy by the precomputed values
2.only replace A by the precomputed value
   I mean only for Ω state of A，the above two method must come to same result in Molpro or not?


  Any suggestion will be appreciated.


-tao





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