SOLUBLE METHANE MONOOXYGENASE; DENSITY-FUNCTIONAL THEORY; EFFECTIVE CORE POTENTIALS; NONHEME IRON ENZYMES; ELECTRONIC-STRUCTURE CONTRIBUTIONS; ACTIVE-SITE CLUSTERS; RIBONUCLEOTIDE REDUCTASE; MOLECULAR CALCULATIONS; SPIN CONTAMINATION; BROKEN-SYMMETRY
ISRAEL JOURNAL OF CHEMISTRY, v.41, no.3, pp.173 - 186
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