Author: And Enrique Ortí

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AUTHOR

And Enrique Ortí

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A Theoretical Determination of the Low-lying Electronic States of the p-Benzosemiquinone Radical Anion

2000

The low-lying electronic states of the p-benzosemiquinone radical anion are studied using multiconfigurational second-order perturbation theory (CASPT2) and extended atomic natural orbital (ANO) ba...

Colloid and Surface ChemistryChemistryPhysics::Atomic and Molecular ClustersPhysics::Atomic PhysicsGeneral ChemistryPhysics::Chemical PhysicsPerturbation theoryAtomic physicsBiochemistryCatalysisIonElectronic statesJournal of the American Chemical Society

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PEPhysical Sciences and Engineering
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  - PE2_4Experimental particle physics without accelerators
  - PE2_6Nuclear, hadron and heavy ion physics
  - PE2_8Gas and plasma physics
  - PE2_5Classical and quantum physics of gravitational interactions
  - PE2_7Nuclear and particle astrophysics
  - PE2_9 Electromagnetism
  - PE2_10Atomic, molecular physics
  - PE2_11Ultra-cold atoms and molecules
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  - PE2_14Lasers, ultra-short lasers and laser physics
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LSLife Sciences
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SHSocial Sciences and Humanities
- SH2Institutions, Governance and Legal Systems
  - SH2_1Political systems, governance
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