Reactivity boundaries for chemical reactions associated with higher-index and multiple saddles.

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Roaming dynamics in ion-molecule reactions: phase space reaction pathways and geometrical interpretation.Phase space barriers and dividing surfaces in the absence of critical points of the potential energy: Application to roaming in ozone.

P2860

Q35142532-D10E15A9-A6D8-43B4-A2C2-E9C360ED458B Q35916520-32D7498E-1B21-46D2-9590-F5F49F73B0BB

P2860

Reactivity boundaries for chemical reactions associated with higher-index and multiple saddles.

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http://www.wikidata.org/entity/Q45354474

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2013 nî lūn-bûn

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2013年の論文

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2013年学术文章

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2013年学术文章

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2013年学术文章

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2013年学术文章

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2013年学术文章

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2013年学术文章

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2013年學術文章

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2013年學術文章

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Reactivity boundaries for chem ...... er-index and multiple saddles.

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Reactivity boundaries for chem ...... er-index and multiple saddles.

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Item

label

Reactivity boundaries for chem ...... er-index and multiple saddles.

@en

Reactivity boundaries for chem ...... er-index and multiple saddles.

@nl

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Reactivity boundaries for chem ...... er-index and multiple saddles.

@en

Reactivity boundaries for chem ...... er-index and multiple saddles.

@nl

P1476

Reactivity boundaries for chem ...... er-index and multiple saddles.

@en

P2093

Chun-Biu Li

http://www.w3.org/2001/XMLSchema#string

Hiroshi Teramoto

http://www.w3.org/2001/XMLSchema#string

Shinnosuke Kawai

http://www.w3.org/2001/XMLSchema#string

Tamiki Komatsuzaki

http://www.w3.org/2001/XMLSchema#string

Yutaka Nagahata

http://www.w3.org/2001/XMLSchema#string

P2860

Accurate ab initio and “hybrid” potential energy surfaces, intramolecular vibrational energies, and classical ir spectrum of the water dimer

Quantum reaction boundary to mediate reactions in laser fields.

Dynamical hierarchy in transition states: why and how does a system climb over the mountain?

Phase space geometry of dynamics passing through saddle coupled with spatial rotation.

Why and how do systems react in thermally fluctuating environments?

Index k saddles and dividing surfaces in phase space with applications to isomerization dynamics.

Roaming radicals.

Ab initio potential energy and dipole moment surfaces of (H2O)2.

Ab initio global potential-energy surface for H5(+) --> H3(+) + H2.

Transition state in a noisy environment.

P304

042923

http://www.w3.org/2001/XMLSchema#string

P31

scholarly article

P356

10.1103/PHYSREVE.88.042923

http://www.w3.org/2001/XMLSchema#string

P407

English

P433

http://www.w3.org/2001/XMLSchema#string

P478

http://www.w3.org/2001/XMLSchema#string

P577

2013-10-29T00:00:00Z

http://www.w3.org/2001/XMLSchema#dateTime

P698

24229265

http://www.w3.org/2001/XMLSchema#string

P818

1308.3048

http://www.w3.org/2001/XMLSchema#string

Reactivity boundaries for chemical reactions associated with higher-index and multiple saddles.

about

P2860

P2860

Reactivity boundaries for chemical reactions associated with higher-index and multiple saddles.

description

name

type

label

prefLabel

P1433

P1476

P2093

P2860

P304

P31

P356

P407

P433

P478

P577

P698

P818

P356

P1433

P1476

P2093

P2860

P304

P31

P356

P407

P433

P478

P577

P698

P818