Publications

1985


Single crystal and magnetic Mössbauer studies on [(C6H 5)4P][(C6H5CH2)-(CH 3)3N][Cl2FeS2MoS2], The Journal of Chemical Physics , vol. 82, no. 8, pp. 3594--3598, 1985.
A.X. Trautwein, E. Bill, R. Bias, S. Lauer, H. Winkler, and A. Kostikas,
Iron sulfur and iron molybdenum sulfur compounds: Comparison of molecular orbital calculations and spin-Hamiltonian analysis of Mössbauer spectra, The Journal of Chemical Physics , vol. 82, no. 8, pp. 3584--3593, 1985.
A.X. Trautwein, E. Bill, R. Bläs, G. Doppler, F. Seel, B. Wolf, R. Klein, and U. Gonser,
Formation of iron clusters in zeolites of the faujasite-type X and Y by thermal decomposition of ironpentacarbonyl, Surface Science , vol. 156, no. PART 1, pp. 140--148, 1985.
A.X. Trautwein, S. Lauer, J. Delhalle, and F.E. Harris,
Application of the FAKE molecular-orbital method to diatomic molecules XY (X, Y = H, F, Cl, Br, I), Theoretica Chimica Acta , vol. 67, no. 3, pp. 175--185, 1985.
E. Bill, F.‐H. H Bernhardt, A.X. X Trautwein, and H. Winkler,
MössBAUER INVESTIGATION OF THE COFACTOR IRON OF PUTIDAMONOOXIN, European Journal of Biochemistry , vol. 147, no. 1, pp. 177--182, 1985.
M. SCHAPPACHER, R. Weiss, R. Montiel-Montoya, A. Trautwein, and A. Tabard,
Formation of an Iron(IV)-Oxo ``Picket-Fence'' Porphyrin Derivative via Reduction of the Ferrous Dioxygen Adduct and Reaction with Carbon Dioxide, Journal of the American Chemical Society , vol. 107, no. 12, pp. 3736--3738, 1985.
A X Trautwein, S Lauer, J Delhalle, and F E Harris,
APPLICATION OF THE FAKE MOLECULAR-ORBITAL METHOD TO DIATOMIC-MOLECULES XY (X,Y=H,F,CL,BR,I), Theoretica Chimica Acta , vol. 67, no. 3, pp. 175--185, 1985.

1984

S Lauer, A X Trautwein, and F E Harris,
ELECTRONIC-STRUCTURE CALCULATIONS, PHOTOELECTRON-SPECTRA, OPTICAL-SPECTRA, AND MössBAUER PARAMETERS FOR THE PYRITES FES2, CO52, NIS2, CUS2, ZNS2, Physical Review B , vol. 29, no. 12, pp. 6774--6783, 1984.
E. Bill, N. Blaes, K.F. Fischer, U. Gonser, K.H. Pauly, R. Preston, F. Seel, R. Staab, and A.X. Trautwein,
Crystal Structure and Mössbauer Spectroscopic Investigation of the Low Temperature Molecular Dynamics of Hexa(2-ethylimidazole)iron(II) Hydridotetracarbonylferrate(-II), Zeitschrift fur Naturforschung - Section B Journal of Chemical Sciences , vol. 39, no. 3, pp. 333--340, 1984.
H.H. Ruf, H. Ahr, W. Nastainczyk, V. Ullrich, R. Montiel-Montoya, A. Trautwein, D. Mansuy, and J.-P. Battioni,
Formation of a Ferric Carbanion Complex from Halothane and Cytochrome P-450: Electron Spin Resonance, Electronic Spectra, and Model Complexes, Biochemistry , vol. 23, no. 22, pp. 5300--5306, 1984.
E Bill, N Blaes, K F Fischer, U Gonser, K H Pauly, R Preston, F Seel, R Staab, and A X Trautwein,
CRYSTAL-STRUCTURE AND MössBAUER SPECTROSCOPIC INVESTIGATION OF THE LOW-TEMPERATURE MOLECULAR-DYNAMICS OF HEXA(2-ETHYLIMIDAZOLE)IRON(II) HYDRIDOTETRACARBONYLFERRATE(-II), Zeitschrift Fur Naturforschung Section B-a Journal of Chemical Sciences , vol. 39, no. 3, pp. 333--340, 1984.

1983

M Schappacher, L Ricard, R Weiss, R Montielmontoya, U Gonser, E Bill, and A Trautwein,
SYNTHESIS AND SPECTROSCOPIC PROPERTIES OF A 5 COORDINATE TETRAFLUOROPHENYLTHIOLATO IRON-II PICKET FENCE PORPHYRIN COMPLEX AND ITS CARBONYL AND DIOXYGEN ADDUCTS - SYNTHETIC ANALOGS FOR THE ACTIVE-SITE OF CYTOCHROMES-P-450, Inorganica Chimica Acta-Bioinorganic Chemistry , vol. 78, no. 2, pp. L9--L12, 1983.
V.R. Marathe, S. Lauer, and A.X. Trautwein,
Electrostatic potentials using direct-lattice summations, Physical Review B , vol. 27, no. 8, pp. 5162--5165, 1983.

X-RAY STRUCTURE AND MössBAUER PROPERTIES OF A SYNTHETIC ANALOG FOR THE ACTIVE-SITE OF OXYCYTOCHROME-P450, Nouveau Journal De Chimie-New Journal of Chemistry , vol. 7, no. 7, pp. 405--408, 1983.

PURE NUCLEAR REFLEXES AND COMBINED HYPERFINE INTERACTIONS IN YIG, Zeitschrift Fur Physik B-Condensed Matter , vol. 49, no. 4, pp. 331--341, 1983.

1981

E. Bill, F.H. H Bernhardt, and A. Trautwein,
MössBAUER STUDIES ON THE COFACTOR OF PUTIDAMONOOXIN (PMO), Biophysics of Structure and Mechanism , vol. 7, no. 4, pp. 250, 1981.
E Bill, F H Bernhardt, and A X Trautwein,
MössBAUER STUDIES ON THE ACTIVE FE ... [2FE-2S] SITE OF PUTIDAMONOOXIN, ITS ELECTRON-TRANSPORT AND DIOXYGEN ACTIVATION MECHANISM, European Journal of Biochemistry , vol. 121, no. 1, pp. 39--46, 1981.
M. SCHAPPACHER, L. RICARD, R. Weiss, R. Montiel-Montoya, U. Gonser, E. Bill, and A. Trautwein,
Models for the Coordination Site of Iron in Cytochrome P-450. Synthesis and Spectroscopic Properties of a Dioxygen Adduct of [(2,3,5,6-Fluorophenyl)thiolato]iron(II) Tetrapheny lpivaloy (porphyrin, Journal of the American Chemical Society , vol. 103, no. 25, pp. 7646--7648, 1981.
H Bunzel, U Gonser, and A Trautwein,
MössBAUER-SPECTROSCOPY ON LITAO3, Ferroelectrics , vol. 38, no. 1-4, pp. 789--792, 1981.

1980

W. Adrian, E. Bill, F.H. Bernhardt, and A. Trautwein,
Mössbauer and kinetic studies on putidamonooxin (PMO), Biophysics of Structure and Mechanism , vol. 6, no. 1 Suppleme, pp. 23--24, 1980.