Heinz Dieter Rudolph

Universität Ulm — Germany

Chemistry · Physical Sciences

30h-index3.0kcitations140works0.02yr avg
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Research Topics

Molecular Spectroscopy and Structure(101), Advanced Chemical Physics Studies(77), Atmospheric Ozone and Climate(52), Spectroscopy and Laser Applications(33), Molecular spectroscopy and chirality(13)

Publications140 total

Cover Feature: The S−S Bridge: A Mixed Experimental‐Computational Estimation of the Equilibrium Structure of Diphenyl Disulfide (ChemPhysChem 3/2019)
ChemPhysChem·2019Open Access
How flexible is the disulfide linker? A combined rotational–computational investigation of diallyl disulfide
Physical Chemistry Chemical Physics·2019· 18 cited
The S−S Bridge: A Mixed Experimental‐Computational Estimation of the Equilibrium Structure of Diphenyl Disulfide
ChemPhysChem·2018· 17 cited
Semiexperimental and mass-dependent structures by the mixed regression method: Accurate equilibrium structure and failure of the Kraitchman method for ethynylcyclohexane
The Journal of Chemical Physics·2018· 20 cited
MICROWAVE SPECTRA OF THE TWO CONFORMERS OF PROPENE-3-d1 AND A SEMIEXPERIMENTAL EQUILIBRIUM STRUCTURE OF PROPENE
2017Open Access
Fourier Transform Microwave Spectrum of Propene-3-<i>d</i><sub>1</sub> (CH<sub>2</sub>═CHCH<sub>2</sub>D), Quadrupole Coupling Constants of Deuterium, and a Semiexperimental Equilibrium Structure of Propene
The Journal of Physical Chemistry A·2017· 12 cited
Determination of accurate semiexperimental equilibrium structure of proline using efficient transformations of anharmonic force fields among the series of isotopologues
Molecular Physics·2017· 10 cited
Axial–equatorial isomerism and semiexperimental equilibrium structures of fluorocyclohexane
Physical Chemistry Chemical Physics·2017· 18 citedOpen Access
The equilibrium molecular structures of 2-deoxyribose and fructose by the semiexperimental mixed estimation method and coupled-cluster computations
Physical Chemistry Chemical Physics·2016· 26 citedOpen Access
ACCURATE EQUILIBRIUM STRUCTURES FOR trans-HEXATRIENE BY THE MIXED ESTIMATION METHOD AND FOR THE THREE ISOMERS OF OCTATETRAENE FROM THEORY; STRUCTURAL CONSEQUENCES OF ELECTRON DELOCALIZATION
2015
Interplay of experiment and theory: high resolution infrared spectrum and accurate equilibrium structure of BF<sub>2</sub>OH
Physical Chemistry Chemical Physics·2015· 17 citedOpen Access
Electron Delocalization in Polyenes: A Semiexperimental Equilibrium Structure for (3<i>E</i>)-1,3,5-Hexatriene and Theoretical Structures for (3<i>Z</i>,5<i>Z</i>)-, (3<i>E</i>,5<i>E</i>)-, and (3<i>E</i>,5<i>Z</i>)-1,3,5,7-Octatetraene
The Journal of Physical Chemistry A·2014· 16 cited
Equilibrium Structures of Three-, Four-, Five-, Six-, and Seven-Membered Unsaturated N-Containing Heterocycles
The Journal of Physical Chemistry A·2014· 46 cited
Why it is sometimes difficult to determine the accurate position of a hydrogen atom by the semiexperimental method: Structure of molecules containing the OH or the CH<sub>3</sub> group
Journal of Computational Chemistry·2014· 28 cited
A benchmark study of molecular structure by experimental and theoretical methods: Equilibrium structure of thymine from microwave rotational constants and coupled-cluster computations
Journal of Molecular Structure·2014· 18 cited
Accurate Equilibrium Structures for Piperidine and Cyclohexane
The Journal of Physical Chemistry A·2014· 21 cited
EQUILIBRIUM STRUCTURE OF PIPERIDINE
2014
Accurate equilibrium structures of fluoro- and chloroderivatives of methane
Molecular Physics·2014· 16 cited
Semiexperimental equilibrium structure of the oblate-top molecules dimethyl sulfoxide and cyclobutene
Journal of Molecular Spectroscopy·2014· 7 cited
Semiexperimental Equilibrium Structures for <i>cis</i>,<i>cis</i>- and <i>trans</i>,<i>trans</i>-1,4-Difluorobutadiene by the Mixed Estimation Method and Definitive Relative Energies of the Isomers
The Journal of Physical Chemistry A·2013· 1 cited
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Frequent Co-authors

J. Demaison(19), H. Dreizler(13), Attila G. Császár(4), I. Botskor(4), Harold Jones(3), Georges Roussy(3), N. Vogt(3), L. Margulès(2), A. Trinkaus(2), Norman C. Craig(2), Emilio J. Cocinero(2), Jens‐Uwe Grabow(2), Alberto Lesarri(2), G. Wlodarczak(2), A. Jaeschke(1), P. Wendung(1), W. A. Kreiner(1), B.T. Tan(1), D. Sutter(1), Helmut Seiler(1)