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![]() | Document Date: 2007-01-03 01:12:34Open Document File Size: 383,25 KBShare Result on FacebookCityPalo Alto / /CompanyQuantum chemical / /Currencypence / / /FacilityCollege of Computing / Georgia Institute of Technology / /IndustryTermminimum-energy configuration / representative hydrocarbon systems / Zero-point vibrational energy corrections / low-pressure chemical vapor deposition4 / excess hydrogen gas / initio bare energy differences / gas-phase hydrocarbons / hydrogen abstraction tool / potential energy surfaces / potential energy surface / analytic energy gradients / open-shell systems / energy lowerings / possible applications / metal-solvated carbon / precursor hydrocarbon gas / activation energy / molecular systems / zero-point vibrational energy correction / energy / performed using analytic energy gradients / /MovieW. 3 / W. 3 3 / /NaturalFeatureSymmetric Reactions Barrier heights / /OrganizationSchool of Chemistry and Biochemistry / Institute for Molecular Manufacturing / Georgia Institute of Technology / Atlanta / College of Computing / Center for Computational Molecular Science and Technology / /PersonRalph C. Merkle / Robert A. Freitas Jr. / David Sherrill / /PositionEa /RT / Renner-Teller / RT / representative / /ProvinceOrStateCalifornia / Georgia / /Technologythermodynamics / crystallization / CVD / /SocialTag |