Nuclear Resonance Vibrational Spectroscopy of Iron Sulfur Proteins
  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 and the high-spin ferrous iron-sulfur center of a rubredoxin-type protein from the thermophylic bacterium Pyrococcus abysii. 
Alfred Xaver Trautwein, Patrick Wegner, Heiner Winkler, Hauke Paulsen,   Volker Sch\"unemann, Christian Schmidt, Aleksandr I...
physics.chem-ph