(Q46936491)

26 December 2017

title

Quadratic string method for determining the minimum-energy path based on multiobjective optimization. (English)

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26 December 2017

author name string

Steven K Burger

series ordinal

1

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26 December 2017

Weitao Yang

series ordinal

2

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26 December 2017

language of work or name

English

0 references

publication date

1 February 2006

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26 December 2017

Journal of Chemical Physics

published in

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26 December 2017

volume

124

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26 December 2017

page(s)

054109

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26 December 2017

issue

5

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26 December 2017

String method for the study of rare events

cites work

1 reference

Parallel iterative reaction path optimization in ab initio quantum mechanical/molecular mechanical modeling of enzyme reactions.

21 January 2018

1 reference

Reaction path determination for quantum mechanical/molecular mechanical modeling of enzyme reactions by combining first order and second order "chain-of-replicas" methods

21 January 2018

1 reference

A doubly nudged elastic band method for finding transition states.

21 January 2018

1 reference

A growing string method for determining transition states: comparison to the nudged elastic band and string methods

21 January 2018

1 reference

Global Optimization by Basin-Hopping and the Lowest Energy Structures of Lennard-Jones Clusters Containing up to 110 Atoms

21 January 2018

1 reference

Ab initio reaction paths and direct dynamics calculations

21 January 2018

1 reference

Nudged elastic band method for finding minimum energy paths of transitions

21 January 2018

1 reference

21 January 2018

Identifiers

DOI

10.1063/1.2163875

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26 December 2017

PubMed ID

16468853

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26 December 2017