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Keyword [Molecular orbitals]
Result: 1 - 3 | Page: 1 of 1
1.
Quantum Chemical Calculation Of The Excited State Potential Energy Surface Of H
2
O～+ By Using The CASSCF Method
2.
The Theoretical Investigation Of Excited-State Intramolecular Single Proton Transfer Mechanism
3.
Moving beyond molecular orbitals with reduced density matrices: Applications to chemiluminescent molecules and strong-field atomic processes
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