Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters.

Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters.

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http://www.wikidata.org/entity/Q46495026
First-principles, quantum-mechanical simulations of electron solvation by a water cluster.Interior- and surface-bound excess electron states in large water cluster anions.A new electron-methanol molecule pseudopotential and its application for the solvated electron in methanol.Efficient floating diffuse functions for accurate characterization of the surface-bound excess electrons in water cluster anions.Study of electronic structure and dynamics of interacting free radicals influenced by water.Benchmark calculations of excess electrons in water cluster cavities: balancing the addition of atom-centered diffuse functions versus floating diffuse functions.Excess electrons in methanol clusters: Beyond the one-electron picture.The static-exchange electron-water pseudopotential, in conjunction with a polarizable water model: a new Hamiltonian for hydrated-electron simulations.On the applicability of one- and many-electron quantum chemistry models for hydrated electron clusters.Electron solvation in water-ammonia mixed clusters: Structure, energetics, and the nature of localization states of the excess electron.Comment on "Does the hydrated electron occupy a cavity?".
P2860

Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters.

Item
http://www.wikidata.org/entity/Q46495026
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2005 nî lūn-bûn
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2005年の論文
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2005年学术文章
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2005年学术文章
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2005年学术文章
@zh-cn
2005年学术文章
@zh-hans
2005年学术文章
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2005年学术文章
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2005年學術文章
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2005年學術文章
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name
Accuracy and limitations of se ...... of solvated-electron clusters.
@en
Accuracy and limitations of se ...... of solvated-electron clusters.
@nl
type
label
Accuracy and limitations of se ...... of solvated-electron clusters.
@en
Accuracy and limitations of se ...... of solvated-electron clusters.
@nl
prefLabel
Accuracy and limitations of se ...... of solvated-electron clusters.
@en
Accuracy and limitations of se ...... of solvated-electron clusters.
@nl
P1433
P1476
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577
P5875
P698
P356
P1433
P1476
Accuracy and limitations of se ...... of solvated-electron clusters.
@en
P2093
P2860
P304
P31
P356
P407
P433
P478
P50
P577
P5875
P698