Results 191 to 200 of about 5,869 (242)
Absorption of Energy in Excess, Photoinhibition, Transpiration, and Foliar Heat Emission Feedback Loops During Global Warming. [PDF]
Zarrin Ghalami R +2 more
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Theoretical study of the photochemistry of Cl2O
Journal of Chemical Physics, 2001This is a theoretical study of the photochemistry of Cl2O based on ab initio potential energy surfaces and trajectory surface-hopping calculations. We calculated quasidiabatic states and couplings for eight singlet states of Cl2O with a multireference perturbation configuration interaction (CI) technique.
Maurizio Persico +2 more
exaly +2 more sources
Theoretical chemistry: current applications to photochemistry and thermochemistry
Theoretical Chemistry Accounts, 2012A historical perspective is given contrasting challenges and advances in theoretical chemistry at the time the first issue of Theoretical Chemistry Accounts appeared in 1962 and the progress achieved since then as expressed in current state-of-the-art applications in photochemistry and thermochemistry.
Fernando Ornellas
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Benzylidene–oxazolones as photoswitches: photochemistry and theoretical calculations
Tetrahedron, 2013Abstract The photophysics and photochemistry of a family of compounds proposed as efficient molecular photoswitches is presented. The effect of different light sources, substituents and solvents in the photostationary state has been explored. A detailed mechanistic description is also discussed.
Ignacio Funes-Ardoiz +2 more
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Theoretical model for enhanced photochemistry on rough surfaces
Journal of Chemical Physics, 1981A simplified theory of enhanced ultraviolet, visible, and infrared photochemistry near rough dielectric and metallic surfaces is described and numerically investigated. Protrusions on a rough surface are modeled as isolated microscopic spheres. We formulate classical equations of motion for molecules interacting with electromagnetic fields and such ...
Abraham Nitzan, Nitzan Abraham
exaly +2 more sources
Recent theoretical developments in photochemistry
Coordination Chemistry Reviews, 1991Kristine Pierloot +2 more
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Theoretical studies of the photochemistry of acyclic azoalkanes
Journal of the American Chemical Society, 1977Irving Epstein, Colin Steel
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Some theoretical aspects of organic photochemistry
Accounts of Chemical Research, 1982exaly +2 more sources

