(Q51993562)

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:15267430%20AND%20SRC:MED&resulttype=core&format=json

30 December 2019

title

Non-Born-Oppenheimer trajectories with self-consistent decay of mixing (English)

1 reference

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30 December 2019

3

1 reference

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30 December 2019

Chaoyuan Zhu

series ordinal

1

1 reference

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30 December 2019

author name string

Ahren W Jasper

series ordinal

2

1 reference

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30 December 2019

language of work or name

English

0 references

publication date

1 March 2004

1 reference

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Journal of Chemical Physics

30 December 2019

published in

1 reference

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30 December 2019

volume

120

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30 December 2019

issue

12

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30 December 2019

page(s)

5543-5557

1 reference

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Army ants algorithm for rare event sampling of delocalized nonadiabatic transitions by trajectory surface hopping and the estimation of sampling errors by the bootstrap method

30 December 2019

cites work

1 reference

Non-Adiabatic Crossing of Energy Levels

21 January 2018

1 reference

A natural decay of mixing algorithm for non-Born–Oppenheimer trajectories

21 January 2018

1 reference

Photodissociation of LiFH and NaFH van der Waals complexes: A semiclassical trajectory study

21 January 2018

1 reference

Conditions for the definition of a strictly diabatic electronic basis for molecular systems

21 January 2018

1 reference

On the nonexistence of strictly diabatic molecular electronic bases

21 January 2018

1 reference

Properties of nonadiabatic couplings and the generalized Born–Oppenheimer approximation

21 January 2018

1 reference

Quantum photochemistry. Accurate quantum scattering calculations for an electronically nonadiabatic reaction

21 January 2018

1 reference

Continuous surface switching: An improved time-dependent self-consistent-field method for nonadiabatic dynamics

21 January 2018

1 reference

The treatment of classically forbidden electronic transitions in semiclassical trajectory surface hopping calculations

21 January 2018

1 reference

The direct calculation of diabatic states based on configurational uniformity

21 January 2018

1 reference

Validation of trajectory surface hopping methods against accurate quantum mechanical dynamics and semiclassical analysis of electronic-to-vibrational energy transfer

21 January 2018

1 reference

Fewest-switches with time uncertainty: A modified trajectory surface-hopping algorithm with better accuracy for classically forbidden electronic transitions

21 January 2018

1 reference

Improved treatment of momentum at classically forbidden electronic transitions in trajectory surface hopping calculations

21 January 2018

1 reference

Do Semiclassical Trajectory Theories Provide an Accurate Picture of Radiationless Decay for Systems with Accessible Surface Crossings?

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.1648306

1 reference

https://www.ebi.ac.uk/europepmc/webservices/rest/search?query=EXT_ID:15267430%20AND%20SRC:MED&resulttype=core&format=json

release_54nqiki3rrbuxk5mfsfqvgfhse

30 December 2019

Fatcat ID

1 reference

Fatcat

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mapped directly with Wikidata item

24 November 2022

based on heuristic

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