On the Origin of Alternating Bond Distortions and the Emergence of Chirality in Polyoxometalate Anions von Yan, Likai, López, Xavier, Carbó, Jorge J, Sniatynsky, Richard, Duncan, Dean C, Poblet, Josep M

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Application of Screened Hybrid Density Functional Theory to Ammonia Decomposition on Silicon von Sniatynsky, Richard, Janesko, Benjamin G, El-Mellouhi, Fedwa, Brothers, Edward N

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Metal−Olefin Interactions in M(CO)5(cycloolefin) (M = Cr, Mo, W; Cycloolefin = Cyclopropene to Cyclooctene):  Strain Relief and Metal−Olefin Bond Strength von Cedeño, David L, Sniatynsky, Richard

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A density functional theory benchmark of the formation enthalpy and first CO dissociation enthalpy of hexacarbonyl complexes of chromium, molybdenum, and tungsten von Sniatynsky, Richard, Cedeño, David L.

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