69 citations · 180 across the 7 of their papers we have counts for
4 papers · 1 filter
Nuclear Resonance Vibrational Spectroscopy of Iron Sulfur Proteins
Alfred Xaver Trautwein, Patrick Wegner, Heiner Winkler +5
Nuclear inelastic scattering in conjunction with density functional theory (DFT) calculations has been applied for the identification of vibrational modes of the high-spin ferric a…
Density functional theory calculations and vibrational spectroscopy on iron spin-crossover compounds
J. A. Wolny, H. Paulsen, A. X. Trautwein +1
Iron complexes with a suitable ligand field undergo spin-crossover (SCO), which can be induced reversibly by temperature, pressure or even light. Therefore, these compounds are hig…
Mössbauer Studies of Coordination Compounds using Synchrotron Radiation
Hauke Paulsen, Volker Schünemann, Alfred Xaver Trautwein +1
Nuclear resonant forward scattering (NFS) and nuclear inelastic scattering (NIS) of synchrotron radiation are fairly recent spectroscopic methods for the investigation of complexes…
Importance of correlation effects in hcp iron revealed by a pressure-induced electronic topological transition
K. Glazyrin, L. V. Pourovskii, L. Dubrovinsky +17
We discover that hcp phases of Fe and Fe0.9Ni0.1 undergo an electronic topological transition at pressures of about 40 GPa. This topological change of the Fermi surface manifests i…