Ab initio spectroscopic studies of non-rigid molecules: An application to acetic acid

DOI10.1007/S10910-011-9836-1zbMATH1303.92144OpenAlexW2041220374MaRDI QIDQ645149FDOQ645149

Authors María Luisa Senent

Publication date 8 November 2011

Published in Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL https://doi.org/10.1007/s10910-011-9836-1

zbMATH Keywords

acetic acidastrochemistrynon-rigid molecules

Mathematics Subject Classification ID

Molecular structure (graph-theoretic methods, methods of differential topology, etc.) (92E10)

Recommendations

• Vibrational isotope effect of linear and planar molecules: Deuterated bromoethenes
• scientific article; zbMATH DE number 1728465
• Spectroscopic study of some diatomic molecules via the proper quantization rule
• Ab Initio Path Integral Simulations of Floppy Molecular Systems
• Vibrational isotope effect by the low rank perturbation method. Case study: out-of-plane vibrations of benzene (H,D)-isotopomers

Cited in

(4)

• Modulational instabilities in acetanilide taking into account both the N–H and the C=O vibrational self-trappings
• Vibrational isotope effect of linear and planar molecules: Deuterated bromoethenes
• Conformational effects in acetyl methoxyphenols
• scientific article; zbMATH DE number 1728465 (Why is no real title available?)

Describes a project that uses

Uses Software

• GAUSSIAN

This page was built for publication: \(Ab\) \(initio\) spectroscopic studies of non-rigid molecules: An application to acetic acid

Report a bug (only for logged in users!)Click here to report a bug for this page (MaRDI item Q645149)