Publications

Derk J. Stufkens, Theo L. Snoeck, Wolfgang Kaim, Thomas Roth, and Barbara. Olbrich-Deussner. Resonance Raman study of (h2-TCNE)M(CO)5 (M = Cr, W; TCNE = tetracyanoethene). Evidence for an olefin-complex $\rightarrow$ metallacyclopropane transition upon low-energy metal-to-ligand charge-transfer excitation. Journal of Organometallic Chemistry, (409)1-2:189--195, 1991. [PUMA: Raman Raman;charge Raman;chromium Raman;hybridization Raman;tungsten carbonyl carbonyltetracyanoethane charge chromium complex metal tetracyanoethane transfer transfer;cyanoethane tungsten]

Monika Sieger, Wolfgang Kaim, Derk J. Stufkens, Theo L. Snoeck, Hermann Stoll, and Stanislav. Zalis. Reduced and excited states of the intermediates (a-diimine)(C5R5)Rh in hydride transfer catalysis schemes: EPR and resonance Raman spectroscopy, and comparative DFT calculations of Co, Rh and Ir analogues. Dalton Transactions, 22:3815--3821, 2004. [PUMA: DFT Raman catalysis cobalt complex;EPR cyclopentadienyl diimine excited hydride intermediate iridium;reduced resonance rhodium spectra state transfer]

Monika Sieger, Matthias Wanner, Wolfgang Kaim, Derk J. Stufkens, Theo L. Snoeck, and Stanislav. Zalis. Low-Valent Cobalt Complexes with Three Different p Acceptor Ligands: Experimental and DFT Studies of the Reduced and the Low-Lying Excited States of (R-DAB)Co(NO)(CO), R-DAB = Substituted 1,4-Diaza-1,4-butadiene. Inorganic Chemistry, (42)10:3340--3346, 2003. [PUMA: DFT;EPR DFT;charge Raman TDDFT;cobalt acceptor azabutadiene cobalt complex excited ligand pi radical state state;IR transfer transition]

Wolfgang Kaim, Stephan Kohlmann, Alistair J. Lees, Theo L. Snoeck, Derk J. Stufkens, and Mthembeni M. Zulu. Reinvestigation of the visible absorption bands of the 2,2'-bipyrimidine complexes W(CO)4(bpym) and (m-bpym)M(CO)42 (M = Mo, W) with resonance Raman spectroscopy; the emission spectrum of (m-bpym)Mo(CO)42. Inorganica Chimica Acta, (210)2:159--165, 1993. [PUMA: Raman absorption complex molybdenum pyrimidine resonance tungsten tungsten;visible]