(Q57402493)

English

Benchmark calculations of thermal reaction rates. II. Direct calculation of the flux autocorrelation function for a canonical ensemble

No description defined

In more languages

default for all languages

No label defined

No description defined

edit

Statements

instance of

scholarly article

0 references

title

Benchmark calculations of thermal reaction rates. II. Direct calculation of the flux autocorrelation function for a canonical ensemble (English)

0 references

Donald G. Truhlar

2

0 references

author name string

Paul N. Day

series ordinal

1

0 references

language of work or name

English

0 references

publication date

February 1991

0 references

published in

Journal of Chemical Physics

0 references

volume

94

0 references

issue

3

0 references

page(s)

2045-2056

0 references

cites work

Benchmark calculations of thermal reaction rates. I. Quantal scattering theory

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.459926

retrieved

21 January 2018

A double many‐body expansion of the two lowest‐energy potential surfaces and nonadiabatic coupling for H3

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.459926

retrieved

21 January 2018

L2 amplitude density method for multichannel inelastic and rearrangement collisions

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.459926

retrieved

21 January 2018

Quantum mechanical algebraic variational methods for inelastic and reactive molecular collisions

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.459926

retrieved

21 January 2018

Improved treatment of threshold contributions in variational transition-state theory

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.459926

retrieved

21 January 2018

An optimized quadrature scheme for matrix elements over the eigenfunctions of general anharmonic potentials

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.459926

retrieved

21 January 2018

Dynamics of a two‐level system coupled to a dissipative bath: Comparisons of analytical theories with Monte Carlo simulation

1 reference

stated in

Crossref

reference URL

https://api.crossref.org/works/10.1063%2F1.459926

retrieved

21 January 2018

Identifiers

DOI

10.1063/1.459926

0 references

(Q57402493)

Benchmark calculations of thermal reaction rates. II. Direct calculation of the flux autocorrelation function for a canonical ensemble

Statements

Identifiers

Sitelinks

Wikipedia(0 entries)

Wikibooks(0 entries)

Wikinews(0 entries)

Wikiquote(0 entries)

Wikisource(0 entries)

Wikiversity(0 entries)

Wikivoyage(0 entries)

Wiktionary(0 entries)

Multilingual sites(0 entries)