About: Accurate Double Many-Body Expansion Potential Energy Surface for N3(4A′′) from Correlation Scaled ab Initio Energies with Extrapolation to the Complete Basis Set Limit†

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About: Accurate Double Many-Body Expansion Potential Energy Surface for N3(4A′′) from Correlation Scaled ab Initio Energies with Extrapolation to the Complete Basis Set Limit† Goto Sponge NotDistinct Permalink

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scientific article published on 01 December 2009

Attributes	Values
rdf:type	Item
description	wetenschappelijk artikel (nl) наукова стаття, опублікована в грудні 2009 (uk) im Dezember 2009 veröffentlichter wissenschaftlicher Artikel (de) artículu científicu espublizáu n'avientu de 2009 (ast) scientific article published on 01 December 2009 (en)
publication date	wds:Q57966408-3CA9E0A3-DB7C-475A-9119-1D904BD523C1
publication date	2009-12-01 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q57966408-6ABE5D1C-FE62-4CD8-95B3-108984E915FF
language of work or name	English
author name string	wds:Q57966408-79BBF64A-02C7-4480-957F-35C48E396BEA
author name string	A. J. C. Varandas
rdfs:label	Accurate Double Many-Body Expansion Potential Energy Surface for N3 (nl) Accurate Double Many-Body Expansion Potential Energy Surface for N3(4A′′) from Correlation Scaled ab Initio Energies with Extrapolation to the Complete Basis Set Limit† (en)
skos:prefLabel	Accurate Double Many-Body Expansion Potential Energy Surface for N3 (nl) Accurate Double Many-Body Expansion Potential Energy Surface for N3(4A′′) from Correlation Scaled ab Initio Energies with Extrapolation to the Complete Basis Set Limit† (en)
name	Accurate Double Many-Body Expansion Potential Energy Surface for N3 (nl) Accurate Double Many-Body Expansion Potential Energy Surface for N3(4A′′) from Correlation Scaled ab Initio Energies with Extrapolation to the Complete Basis Set Limit† (en)
author	wds:Q57966408-B6B2BD75-A103-4DAD-867F-4CAAB80CD198 wds:Q57966408-E44CD543-9610-4824-9121-69988B8A9C9B
author	António Varandas Breno Galvão
title	wds:Q57966408-2B0C4BF0-AF01-4C75-AFEE-5C8E3D3E2EF4
title	Accurate double many-body expansion potential energy surface for N3((4)A'') from correlation scaled ab initio energies with extrapolation to the complete basis set limit (en)
page(s)	wds:Q57966408-B67AEBFE-C9B1-4899-8F79-2B3DB76DAEF0
page(s)	14424-14430
instance of	wds:Q57966408-98DD15E4-96A9-4E94-9DB1-BFAD9E9F955E
instance of	scholarly article
main subject	wds:Q57966408-4284E4EB-DB3B-4E52-B27E-06615BAEA888
main subject	potential energy
PubMed ID	wds:Q57966408-FB4BA741-507B-497C-9114-658A780147EB
PubMed ID	http://rdf.ncbi.nlm.nih.gov/pubchem/reference/19681622
PubMed ID	19681622
published in	wds:Q57966408-AB0E773F-F47C-44DD-88C6-DE289F821F3A
published in	Journal of Physical Chemistry A
issue	wds:Q57966408-894833E5-8E14-4AF4-BB93-6F1E57A80F45
volume	wds:Q57966408-1D9C4814-CF33-4122-9AE3-F20A6A96B793
issue	52
volume	113
DOI	wds:Q57966408-E55E9993-996D-47B1-8D65-DD5EC12164CB
DOI	http://dx.doi.org/10.1021/JP903719H
DOI	10.1021/JP903719H
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q57966408
is cites work of	N(4S /2D)+N2: Accurate ab initio-based DMBE potential energy surfaces and surface-hopping dynamics Rovibrational internal energy transfer and dissociation of N2(1Σg+)-N(4S(u)) system in hypersonic flows. Accurate ab initio-based double many-body expansion potential energy surface for the adiabatic ground-state of the C3 radical including combined Jahn-Teller plus pseudo-Jahn-Teller interactions Spin-component-scaling second-order Møller-Plesset theory and its variants for economical correlation energies: unified theoretical interpretation and use for quartet N3. Adaptive coarse graining method for energy transfer and dissociation kinetics of polyatomic species Global ab initio ground-state potential energy surface of N4. Potential energy surfaces for O + O2 collisions. Comparison of potential energy surfaces and computed rate coefficients for N2 dissociation
is cites work of	wds:Q51263414-D837DB85-142F-4D72-8F98-B577B9BFA12F wds:Q45360808-32525DC7-55AA-4619-834A-E4EB49862882 wds:Q45064981-2A2C4EAA-294D-4731-9CF3-156ABCAF7277 wds:Q45788502-DF766FFE-002C-4A03-97DE-7DF0A2B8E044 wds:Q47749936-A183E342-4A27-4A45-9482-357E1D6BFA06 wds:Q57966319-D64F680A-04B8-4C7C-9381-67E7C729D2F1 wds:Q92236273-41B0AB61-053B-44F0-BB0B-C3C585577818 wds:Q57966367-F7F04A8D-61E4-47C6-9A44-E317AF4448DD

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