TY - RPRT TI - Correlation between computed gas-phase and experimentally determined solution-phase infrared spectra: models of the iron-iron hydrogenase enzyme active site. AU - Jesse W Tye AU - Marcetta Y Darensbourg AU - Michael B Hall PY - 2006 DO - 10.1002/jcc.20456 UR - https://pubmed.ncbi.nlm.nih.gov/16807976/ ID - 16807976 ER -