Publications of David Luckhaus  

[1] Andreas Amrein, David Luckhaus, Frederic Merkt, and Martin Quack. High-Resolution FTIR Spectroscopy of CHCLF2 in a Supersonic Free Jet Expansion. Chem. Phys. Lett. 152:275-280 (1988).

[2] Amanda J. Ross, Andreas Amrein, David Luckhaus, and Martin Quack. The Rotational Structure of the v4-band of CH35ClF2. Mol. Phys. 66:1273-1277 (1989).

[3] David Luckhaus and Martin Quack. The Far Infrared Pure Rotational Spectrum and the Coriolis Coupling between v3 and v8 in CH35ClF2. Mol. Phys. 68:745-758 (1989).

[4] Alfred Bauder, Joseph Dommen, Hans Hollenstein, David Luckhaus, and Martin Quack. The v6 Fundamental Band of Peroxyformic Acid near 1125 cm-1. J. Mol. Spectrosc. 143:268-283 (1990).

[5] David Luckhaus and Martin Quack. The Rovibrational Analysis of the High-Resolution IR Spectrum of CD2HF below 1200 cm-1: An Interacting Tetrad of Vibrational Levels. Chem. Phys. Lett. 180:524-532 (1991).

[6] David Luckhaus and Martin Quack. Spectrum and Dynamics of the CH Chromophore in CD2HF. I. Vibrational Hamiltonian and Analysis of Rovibrational Spectra. Chem. Phys. Lett. 190:581-589 (1992).

[7] Tae-Kyu Ha, David Luckhaus, and Martin Quack. Spectrum and Dynamics of the CH Chromophore in CD2HF. II. Ab Initio Calculations of the Potential and Dipole Moment Functions. Chem. Phys. Lett. 190:590-598 (1992).

[8] David Luckhaus and Martin Quack. High-Resolution FTIR spectra of NO2 and N2O4 in Supersonic Jet Expansions and Their Rovibrational Analysis. Chem. Phys. Lett. 199:293-301 (1992).

[9] David Luckhaus and Martin Quack. The Role of Potential Anisotropy in the Dynamics of the CH Chromophore in CHX3 (C3v) Symmetric Tops . Chem. Phys. Lett. 205 :277-284 (1993).

[10] Hans Hollenstein, David Luckhaus, and Martin Quack. Dynamics of the CH Chromophore in CHX3: A Combined Treatment of a Set of Isotopic Species. J. Mol. Struc. 294:65-70 (1993).

[11] David Luckhaus and Martin Quack. High-Resolution FTIR spectra of ''NOx'' (NO2,N2O4) in Supersonic Jet Expansions and Their Rovibrational Analysis . J. Mol. Struc. 293:213-216 (1993).

[12] David Luckhaus, Martin Quack, and Jürgen Stohner. Femtosecond Quantum Structure, Equilibrium and Time Reversal for the CH-Chromophore Dynamics in CD2HF. Chem. Phys. Lett. 212 :434-443 (1993).

[13] Eberhard Riedle, Andreas Beil, David Luckhaus, and Martin Quack. Sub-Doppler Supersonic Jet Spectra of the coupled 6a01 and 6b01 Vibronic Bands of the S1(1B2u) -- S0(1A1g) Transition in Monodeuterobenzene and their Rovibrational Analysis. Mol. Phys. 81:1-15 (1994).

[14] Andreas Beil, David Luckhaus, Roberto Marquardt, and Martin Quack. Intramolecular Energy Transfer and Vibrational Redistribution in Chiral Molecules: Experiment and Theory. Faraday Disc. Chem. Soc. 99:49-76 (1994).

[15] Stephens, Buckingham, Nafile, Polavarapu, Keiderling, Hester, Hecht, Barron, Weiser, Slobodyanyuk, Diem, Malon, Bour, Andreas Beil, David Luckhaus, Roberto Marquardt, Martin Quack, Hansen, Stewart, Hicks, Sugeta, Simons, Freedman, Drake. Vibrational Optical-Activity - From Fundamentals to Biological Applications - 19th-21st December,1994. Faraday Disc. Chem. Soc. 99: 87-101 (1994).

[16] Jacqueline L.Scott, David Luckhaus, Steven S. Brown, and F. Fleming Crim. Overtone Spectroscopy of the Hydroxyl Stretch Vibration in Hydroxylamin (NH2OH). J. Chem. Phys. 102 :675 (1995).

[17] David Luckhaus, Martin Quack, Ulrich Schmitt, and Martin A. Suhm. On the FTIR Spectroscopy in Asynchronously Pulsed Supersonic Free Jet Expansions and on the Interpretation of Stretching Spectra of HF Clusters. Ber. Bunsenges. Phys. Chem. 99:457-468 (1995).

[18] Andreas Beil, David Luckhaus, and Martin Quack. Fermi Resonance Structure and Femtosecond Quantum Dynamics of a Chiral Molecule from the Analysis of Vibrational Overtone Spectra of CHBrClF. Ber. Bunsenges. Phys. Chem. 100:1853-1875 (1996).

[19] David Luckhaus, Martin J. Coffey, Mark D. Fritz,and F. Fleming Crim. Experimental and theoretical overtone spectra of vCH=3,4,5, and 6 in Formaldehyde (H2CO). J. Chem. Phys. 104 :3472-3478 (1996).

[20] Alfred Bauder, Andreas Beil, David Luckhaus, Franz Müller, and Martin Quack. Combined High Resolution Infrared and Microwave Study of Bromochlorofluoromethane. J. Chem. Phys. 106:7588 (1997).

[21] Hans Hollenstein, David Luckhaus, Jörg Pochert, Martin Quack and Georg Seyfang. Synthesis, structure, high resolution spectroscopy and mechanism of the laser chemistry of fluoroxirane and 2,2-[2H]-fluoroxirane. Angewandte Chemie Intl. Ed. (English) 36:140 (1997).

[22] David Luckhaus. The Rovibrational Spectrum of Hydroxylamine: A Combined High Resolution Experimental and Theoretical Study. J. Chem. Phys. 106:8409-8426 (1997).

[23] David Luckhaus. The Rovibrational Dynamics of Hydroxylamine. Ber. Bunsenges. Phys. Chem. 101:346-355 (1997).

[24] Andreas Beil, David Luckhaus, Martin Quack, and J<u"rgen Stohner. Intramolecular Vibrational Redistribution and Unimolecular Reaction: Concepts and New Results on the Femtosecond Dynamics and Statistics of CHBrClF. Ber. Bunsenges. Phys. Chem. 101:311 (1997).

[25] Benjamin Fehrensen, David Luckhaus, and Martin Quack. Inversion tunneling in aniline from high resolution infrared spectroscopy and an adiabatic reaction path Hamiltonian approach. Z. Physik. Chem. 209:1-19 (1999).

[26] Bernd Kuhn, Thomas R. Rizzo, David Luckhaus, Martin Quack, and Martin A. Suhm. A new six-dimensional analytical potential up to chemically significant energies for the electronic ground state of hydrogen peroxide. J. Chem. Phys. 111:2565-2587 (1999).

[27] Benjamin Fehrensen, David Luckhaus, and Martin Quack. Mode Selective Stereomutation Tunnelling in Hydrogen Peroxide Isotopomers. Chem. Phys. Lett. 300:312-320 (1999).

[28] David Luckhaus, Jacqueline L. Scott, and F. Fleming Crim. An experimental and theoretical study of the vibrationally mediated photodissociation of hydroxylamine. J. Chem. Phys.  110:1533-1541 (1999).

[29] Laszlo Nemes, David Luckhaus, Martin Quack, and J. W. C. Johns. Deperturbation of the Low Frequency Infrared Modes of Ketene (CH2CO). J. Mol. Structure 517-518:217-226 (2000).

[30] David Luckhaus. 6D vibrational quantum dynamics: Generalized coordinate discrete variable representation and (a)diabatic contraction. J. Chem. Phys. 113:1329-1347 (2000).

[31] David Luckhaus, Martin Quack, and Martin Willeke. Coupling Across Bonds: Ab initio Calculations for the Anharmonic Resonance Dynamics of the Coupled OH and CH Chromophores in Trans Formic Acid HCOOH. Z. Physik. Chem. 214:1087-1114 (2000).

[32] Michael Gottselig, David Luckhaus, Martin Quack, Jürgen Stohner, and Martin Willeke. Mode Selective Stereomutation and Parity Violation in Disulphane  Isotopomers H2S2, D2S2, T2S2. Helvetica Chimica Acta 84: 1846-1861  (2001).

[33] David Luckhaus and Martin Quack. Gas--Phase Kinetics, in Encyclopedia of Chemical Physics and Physical Chemistry, N. Spencer, ed., Vol.1 Fundamentals, Ch. A3.4 , pp. 653-682,  Institute of Physics, London 2001.

[34] David Luckhaus and Martin Quack Gas--Phase Kinetics Studies, in Encyclopedia of Chemical Physics and Physical Chemistry, N. Spencer, ed., Vol.2 Methods, Ch. B2.5, pp. 1871-1904, Institute of Physics, London 2001.

[35] Ruth Signorell and David Luckhaus. Aerosol Spectroscopy of Dihydroxyacetone: Gasphase and Nanoparticles. Submitted to J. Phys. Chem. A , 106 (19): 4855-4867 (2002).

[36] Otto Dopfer and David Luckhaus. Ro-vibrational Calculations for CH3+ Rg (Rg=He,Ne): The Prototype Disk-and-Ball Dimer. J. Chem. Phys. 116: 1012-1021 (2002).

[37] David Luckhaus. Spectroscopy and Quantum Dynamics: From Vibrations to Reactions. CHIMIA 56 (1/2): 8—12 (2002).

[38] David Luckhaus. From High Resolution Spectroscopy to Detailed Molecular Quantum Dynamics, in Wide-Amplitude Rovibrational Bound States in Polyatomic Molecules, I. N. Kozin, M. M. Law and J. N. L. Connor (eds.) (CCP6, 2002), ISBN 0-9522736-8-3.

[39] Roberto Marquardt, Martin Quack, Ioannis Thanopulos, and David Luckhaus. Tunneling Dynamics of the Infrared NH Chromophore in NHD2. J. Chem. Phys., 118: 643-658 (2003).

[40] Corinna Emmeluth, Martin A. Suhm, and David Luckhaus. A monomers-in-Dimers Model for Carboxylic Acid Dimers. J. Chem. Phys., 118: 2242-2255 (2003).

[41] Benjamin Fehrensen, David Luckhaus, Martin Quack, Martin Willeke, and Thomas R. Rizzo. Ab initio calculations of mode selective tunneling dynamics in 12CH3OH and 13CH3OH. J. Chem. Phys. 119: 5534-5544 (2003).

[42] David Luckhaus. The vibrational spectrum of HONO: fully coupled 6D direct dynamics. J. Chem. Phys., 118: 8797-8806 (2003).

[43] Roberto Marquardt, Martin Quack, Ioannis Thanopulos, and David Luckhaus. A global electric dipole function of ammonia and isotopomers in the electronic ground state.  J. Chem. Phys., 119: 10724-10732 (2003).

[44] Martin Jetzki, David Luckhaus, and Ruth Signorell. Fermi resonance and conformation in glycolaldehyde particles. Can. J. Chem. 82: 915-924  (2004).

[45] David Luckhaus. Multi-arrangement quantum dynamics in 6D: cis-trans isomerization and 1,3--hydrogen transfer in HONO. Chem. Phys. (2004) 304(1-2): 79-90.

[46] Chuanxi Duan and David Luckhaus,  High Resolution IR-Diode Laser Jet Spectroscopy of Malonaldehyde, Chem. Phys. Lett. 391(1-3): 129-133 (2004)



Revised: October 6, 2004