TY - JOUR AU - Hong Wu AU - Michael B. Hall TI - Density functional theory on the larger active site models for [NiFe] hydrogenases: Two-state reactivity? JO - Comptes Rendus. Chimie PY - 2008 SP - 790 EP - 804 VL - 11 IS - 8 PB - Elsevier DO - 10.1016/j.crci.2008.04.005 LA - en ID - CRCHIM_2008__11_8_790_0 ER -