Author Topic: some questions about calculation of MPSH  (Read 4115 times)

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Offline fan0221

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some questions about calculation of MPSH
« on: April 17, 2011, 03:33 »
Dear all,

I wonder how does the Molecular Projected Self-Consistent Hamiltonian(MPSH) in ATK 11.2 is calculated.
I have read the whole manual, and don't find it.

Any advice is welcome.

Best.

Offline nori

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Offline hejun8035

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Re: some questions about calculation of MPSH
« Reply #2 on: April 18, 2011, 02:47 »
Thanks!