Publications

2007

  • K.A. Henzler-Wildman, V. Thai, M. Lei, M. Ott, M. Wolf-Watz, T. Fenn, E. Pozharski, M.A. Wilson, G.A. Petsko, M. Karplus, C.G. Hübner and D. Kern,
    Intrinsic motions along an enzymatic reaction trajectory , Nature , vol. 450, no. 7171, pp. 838--844, 2007.

  • Y. Garcia, H. Paulsen, V. Schünemann, A.X. Trautwein and J.A. Wolny,
    Estimate of the vibrational contribution to the entropy change associated with the spin transition in the d4 systems [MnIII(pyrol) 3tren] and [CrII(depe)2I2] , Physical Chemistry Chemical Physics , vol. 9, no. 10, pp. 1194--1201, 2007.

  • Y Garcia, H Paulsen, V Schünemann, A X Trautwein and J A Wolny,
    Estimate of the vibrational contribution to the entropy change associated with the spin transition in the d(4) systems [Mn (III)(pyrol)(3)tren] and [Cr-II(depe) I-2(2)] , Physical Chemistry Chemical Physics , vol. 9, no. 10, pp. 1194--1201, 2007.

  • H.-P. P Hersleth, T. Uchida, A K Rohr, T. Teschner, V Schuenemann, T. Kitagawa, A.X. X Trautwein, C H Gorbitz, K.K. K Andersson, Å.K. Røhr, V. Schünemann and C.H. Görbitz,
    Crystallographic and spectroscopic studies of peroxide-derived myoglobin compound II and occurrence of protonated Fe-IV-O , Journal of Biological Chemistry , vol. 282, no. 32, pp. 23372--23386, 2007.

  • Damien Faivre, Lars H Böttger, Berthold F Matzanke and Dirk Schüler,
    Intracellular Magnetite Biomineralization in Bacteria Proceeds by a Distinct Pathway Involving Membrane-Bound Ferritin and an Iron(II) Species , Angewandte Chemie International Edition , vol. 46, no. 44, pp. 8495--8499, 2007.

  • 2006

  • V Schünemann, C Jung, A X Trautwein and F Lendzian,
    Reaction intermediates in NO synthases and cytochrome P450 , Abstracts of Papers of the American Chemical Society , vol. 231, pp. 2, 2006.

  • A Ahmedova, V Rusanov, A Hazell, J A Wolny, G Gochev, A X Trautwein and M Mitewa,
    X-ray and Fe-57 Mössbauer study on a Fe(III) complex of 2-acetyl-1,3-indandione , Inorganica Chimica Acta , vol. 359, no. 10, pp. 3123--3128, 2006.

  • A. Ahmedova, V. Rusanov, A. Hazell, J.A. Wolny, G. Gochev, A.X. Trautwein and M. Mitewa,
    X-ray and 57Fe Mössbauer study on a Fe(III) complex of 2-acetyl-1,3-indandione , Inorganica Chimica Acta , vol. 359, no. 10, pp. 3123--3128, 2006.

  • K.L. Ronayne, H. Paulsen, A. Höfer, A.C. Dennis, J.A. Wolny, A.I. Chumakov, V. Schünemann, H. Winkler, H. Spiering, A. Bousseksou, A.X. Trautwein and J.J. McGarvey,
    Vibrational spectrum of the spin crossover complex [Fe(phen) 2(NCS)2] studied by IR and Raman spectroscopy, nuclear inelastic scattering and DFT calculations , Physical Chemistry Chemical Physics , vol. 8, no. 40, pp. 4685--4693, 2006.

  • Richard Börner,
    Verifikation zweidimensionaler Dosisverteilungen mithilfe des Beam Image Systems von Wellhöfer , Thesis, 2006.

  • R.W. Saalfrank, A. Scheurer, I. Bernt, F.W. Heinemann, A.V. Postnikov, V. Schünemann, A.X. Trautwein, M.S. Alam, H. Rupp and P. Müller,
    The FeIII[FeIII(L1)2] 3 star-type single-molecule magnet , Dalton Transactions , no. 23, pp. 2865--2874, 2006.

  • R W Saalfrank, A Scheurer, I Bernt, F W Heinemann, A V Postnikov, V Schünemann, A X Trautwein, M S Alam, H Rupp and P Müller,
    The Fe-III[Fe-III(L-1)(2)](3) star-type single-molecule magnet , Dalton Transactions , no. 23, pp. 2865--2874, 2006.

  • R.W. Saalfrank, A. Scheurer, I. Bernt, F.W. Heinemann, A.V. Postnikov, V. Schünemann, A.X. Trautwein, M.S. Alam, H. Rupp and P. Müller,
    The (FeIII[FeIII(L1)2]3) star-type single-molecule magnet , Journal of the Chemical Society. Dalton Transactions , no. 23, pp. 2865--2874, 2006.

  • R. Prakash, R.W. Saalfrank, H. Maid, A. Scheurer, F.W. Heinemann, A.X. Trautwein and L.H. Böttger,
    Synthesis and redox properties of mixed-valent octanuclear iron defective hexacubanes and a (CaCl)-capped body-centered six-sided iron(III) polyhedron , Angewandte Chemie - International Edition , vol. 45, no. 35, pp. 5885--5889, 2006.

  • R.W. W Saalfrank, R. Prakash, H. Maid, F. Hampel, F.W. W Heinemann, A.X. X Trautwein, L H Böttger and L.H. Böttger,
    Synthesis and characterization of metal-centered, six-membered, mixed-valent, heterometallic wheels of iron, manganese, and indium , Chemistry-a European Journal , vol. 12, no. 9, pp. 2428--2433, 2006.

  • L.H. Böttger, A.I. I Chumakov, C. {Matthias Grunert}, P. Gütlich, J. Kusz, H. Paulsen, U. Ponkratz, V. Rusanov, A.X. X Trautwein, J.A. A Wolny, L H Böttger, C M Grunert and P Gutlich,
    Spin- and phase transition in the spin crossover complex [Fe(Ptz)(6)](BF4)(2) studied by nuclear inelastic scattering of synchrotron radiation and by DFT calculations , Chemical Physics Letters , vol. 429, no. 1-3, pp. 189--193, 2006.

  • C G Hübner and T Basché,
    Optical microscopy and spectroscopy of single molecules , Lanzani, G, Eds. Wiley-VCH, 2006.

  • V. Rusanov, S. Stankov, V. Gushterov, L. Tsankov and A.X. X Trautwein,
    Determination of Lamb-Mössbauer factors and lattice dynamics in some nitroprusside single crystals , Hyperfine Interactions , vol. 169, no. 1-3, pp. 1279--1283, 2006.

  • G Lemercier, N Brefuel, S Shova, J A Wolny, F Dahan, M Verelst, H Paulsen, A X Trautwein and J P Tuchagues,
    A range of spin-crossover temperature T-1/2 > 300 K results from out-of-sphere anion exchange in a series of ferrous materials based on the 4-(4-imidazolylmethyl)-2-(2-imidazolylmethy)imidazole (trim) ligand, [Fe(trim)(2)]X-2 (X=F, Cl, Br, I): Comparison , Chemistry-a European Journal , vol. 12, no. 28, pp. 7421--7432, 2006.

  • G. Lemercier, N. Bréfuel, S. Shova, J.A. Wolny, F. Dahan, M. Verelst, H. Paulsen, A.X. Trautwein and J.-P. Tuchagues,
    A range of spin-crossover temperature T1/2 > 300 K results from out-of-sphere anion exchange in a series of ferrous materials based on the 4-(4-imidazolylmethyl)-2-(2-imidazolylmethyl)imidazole (trim) ligand, [Fe(trim)2]X<sub>2</i , Chemistry - A European Journal , vol. 12, no. 28, pp. 7421--7432, 2006.

  • A L Barra, A K Hassan, A Janoschka, C L Schmidt and V Schünemann,
    Broad-band quasi-optical HF-EPR spectroscopy: Application to the study of the ferrous iron center from a rubredoxin mutant , Applied Magnetic Resonance , vol. 30, no. 3-4, pp. 385--397, 2006.

  • H. Reents, I. Gruner, U. Harmening, L H Böttger, G. Layer, P. Heathcote, A.X. X Trautwein, D. Jahn, E Hartig, L.H. Böttger and E. Härtig,
    Bacillus subtilis Fnr senses oxygen via a [4Fe-4S] cluster coordinated by three cysteine residues without change in the oligomeric state , Molecular Microbiology , vol. 60, no. 6, pp. 1432--1445, 2006.

  • J.A. A Wolny, H. Paulsen, H. Winkler, A.X. X Trautwein and J.-P. P Tuchagues,
    DFT calculations as a tool to analyse quadrupole splittings of spin crossover Fe(II) complexes , Hyperfine Interactions , vol. 166, no. 1-4, pp. 495--498, 2006.

  • V. Rusanov, V. Gushterov, H. Winkler and A.X. X Trautwein,
    Iron-containing atmospheric aerosols in the Chernobyl fallout , Hyperfine Interactions , vol. 166, no. 1-4, pp. 625--630, 2006.

  • H. Winkler, V. Rusanov, J.J. J McGarvey, H. Toftlund, A.X. X Trautwein and J.A. A Wolny,
    Light-induced spin crossover observed for a Fe(II) complex embedded in a Nafion membrane , Hyperfine Interactions , vol. 169, no. 1-3, pp. 1389--1392, 2006.