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First-principles GW calculations for fullerenes, porphyrins, phtalocyanine, and other molecules of interest for organic photovoltaic applications
First-principles GW calculations for fullerenes fullerenes porphyrins phtalocyanine
2010/11/23
We evaluate the performances of ab initio GW calculations for the ionization energies and HOMOLUMOgaps of thirteen gas phase molecules of interest for organic electronic and photovoltaic applications,...
Reconstruction of the biogeochemistry and ecology of photoautotrophs based on the nitrogen and carbon isotopic compositions of vanadyl porphyrins from Miocene siliceous sediments
Reconstruction biogeochemistry ecology photoautotrophs isotopic compositions
2010/1/15
We determined both the nitrogen and carbon isotopic compositions of various vanadyl alkylporphyrins isolated from siliceous marine sediments of the Onnagawa Formation (middle Miocene, northeastern Jap...
Structural Studies of Water-Soluble b-Brominated Manganese Porphyrins: Stabilities of MnTDCSPPBr 8 and MnTSPPBr 8 as Homogeneous and Supported Reagents Toward Hydrogen Peroxide and Sodium Hypochlorite
Water-Soluble b-Brominated Manganese Porphyrins Stabilities of MnTDCSPPBr 8 MnTSPPBr 8 as Homogeneous Supported Reagents Toward Hydrogen Peroxide Sodium Hypochlorite
2010/6/27
This article describes the structural stabilities of [2,3,7,8,12,13,17,18-octabromo-5,10,15,20-tetrakis(2,6-dichloro-3-sulfonatophenyl)porphinato]manganese(III) X (where X = H2O and/or OH- , depending...