Structures and stabilities of the radical anions [H2P2]•-, [H2PN]•-, and [H2N2]•-. An ab initio study
Identifieur interne : 002332 ( Main/Exploration ); précédent : 002331; suivant : 002333Structures and stabilities of the radical anions [H2P2]•-, [H2PN]•-, and [H2N2]•-. An ab initio study
Auteurs : MINH THO NGUYENSource :
- Journal of physical Chemistry [ 0022-3654 ] ; 1987.
Descripteurs français
- Pascal (Inist)
- Etude théorique, Méthode ab initio, Théorie Hartree Fock sans contrainte, Orbitale gaussienne, Fonction polarisation, Fonction diffuse, Corrélation électronique, Partition Moller Plesset, Conformation, Stabilité, Radical libre minéral anionique, Phosphinidène(phosphino) anion, Aminylène(phosphino) anion, Aminylène(amino) anion.
English descriptors
- KwdEn :
Affiliations:
Links toward previous steps (curation, corpus...)
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- to stream Main, to step Curation: 002332
Le document en format XML
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]<sup>•-</sup>
, [H<sub>2</sub>
PN]<sup>•-</sup>
, and [H<sub>2</sub>
N<sub>2</sub>
]<sup>•-</sup>
. An ab initio study</title>
<author><name sortKey="Minh Tho Nguyen" sort="Minh Tho Nguyen" uniqKey="Minh Tho Nguyen" last="Minh Tho Nguyen">MINH THO NGUYEN</name>
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P<sub>2</sub>
]<sup>•-</sup>
, [H<sub>2</sub>
PN]<sup>•-</sup>
, and [H<sub>2</sub>
N<sub>2</sub>
]<sup>•-</sup>
. An ab initio study</title>
<author><name sortKey="Minh Tho Nguyen" sort="Minh Tho Nguyen" uniqKey="Minh Tho Nguyen" last="Minh Tho Nguyen">MINH THO NGUYEN</name>
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<series><title level="j" type="main">Journal of physical Chemistry</title>
<title level="j" type="abbreviated">J. Phys. Chem.</title>
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<term>Diffuse function</term>
<term>Electron correlation</term>
<term>Gaussian orbital</term>
<term>Inorganic radical anion</term>
<term>Moller Plesset partition</term>
<term>Polarization function</term>
<term>Stability</term>
<term>Theoretical study</term>
<term>Unrestricted Hartree Fock theory</term>
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<keywords scheme="Pascal" xml:lang="fr"><term>Etude théorique</term>
<term>Méthode ab initio</term>
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<term>Orbitale gaussienne</term>
<term>Fonction polarisation</term>
<term>Fonction diffuse</term>
<term>Corrélation électronique</term>
<term>Partition Moller Plesset</term>
<term>Conformation</term>
<term>Stabilité</term>
<term>Radical libre minéral anionique</term>
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