Possible to restart CCSD or CCSDT TCE calculations?

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Forum Vet

5:48:27 PM PDT - Wed, Apr 3rd 2019

When spherical is used, the result on Ubuntu18.04 becomes
...
Singles contributions

Doubles contributions

CCSD(T)

Using plain CCSD(T) code

...

CCSD[T]  correction energy / hartree =        ...

CCSD[T] correlation energy / hartree =        ...

CCSD[T] total energy / hartree       =       ...

CCSD(T)  correction energy / hartree =        

CCSD(T) correlation energy / hartree =        

CCSD(T) total energy / hartree       =      ...

The repeated one gives
...

CCSD[T]  correction energy / hartree =        ...

CCSD[T] correlation energy / hartree =        ...

CCSD[T] total energy / hartree       =      ...

CCSD(T)  correction energy / hartree =       

CCSD(T) correlation energy / hartree =        

CCSD(T) total energy / hartree       =     ..

The two results can be called identical.