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Rotational spectroscopy / Multipole expansion / Potential energy / Physics / Spectroscopy / Rotation


Article pubs.acs.org/JPCA Three-Dimensional Ab Initio Potential Energy Surface for H−CO(X̃2A′) Lei Song, Ad van der Avoird, and Gerrit C. Groenenboom* Theoretical Chemistry, Institute for Molecules and Materials, Ra
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Document Date: 2013-09-21 18:20:58


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City

Houston / Chichester / Austin / New York / Shepler / /

Company

org/JPCA Three-Dimensional Ab / H and CO / HCO and CO / L. B. Ab / CO and CO / E. F. CO / R. M. Ab / Wilson / Jz / ASSOCIATED CONTENT / /

Country

Netherlands / United Kingdom / /

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Event

M&A / /

Facility

H−CO complex / /

IndustryTerm

energy levels / energy region / multidimensional molecular potential energy surfaces / atomic and molecular hydrogen gas / diatomic molecule potential energy curves / potential energy surfaces / interaction energy / angular momentum operator / lower energy scattering calculations / dissociation energy / lowest energy / gas phase reaction / energy / correlation energy / dilute gas / zero-point vibrational energy / ab initio dissociation energy / analytical 3D potential energy surface / initio potential energy curve / lower energy region / potential energy surface / initio potential energy surface / interaction operator / energy curves / vibrational zero-point energy / velocity map imaging / calculated rotational energy levels / /

Organization

University of Waterloo Chemical Physics Research Report / V(sr) / Institute for Molecules and Materials / Organisation for Scientific Research / /

Person

Joel M. Bowman Festschrift / Dixon / Naduvalath Balakrishnan / Werner-Keller / Jonathan Tennyson / Stefan Andersson / W. Leo Meerts / Ad van der Avoird / Lei Song / Gerrit C. Groenenboom / Jansen / /

Position

D. J. / AUTHOR INFORMATION Corresponding Author *E-mail / Renner−Teller / R. N. / /

Product

3D H−CO / /

ProgrammingLanguage

R / C / K / Fortran / /

ProvinceOrState

British Columbia / HCO / Colorado / /

Technology

microwave / laser / spectroscopy / http / /

URL

http /

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