Result Number | Material Type | Add to My Shelf Action | Record Details and Options |
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1 |
Material Type: Artigo
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0–0 Energies Using Hybrid Schemes: Benchmarks of TD-DFT, CIS(D), ADC(2), CC2, and BSE/GW formalisms for 80 Real-Life CompoundsJacquemin, Denis ; Duchemin, Ivan ; Blase, XavierJournal of chemical theory and computation, 2015-11, Vol.11 (11), p.5340-5359 [Periódico revisado por pares]United States: American Chemical SocietyTexto completo disponível |
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2 |
Material Type: Artigo
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0D/1D organic ferroelectrics/multiferroics for ultrahigh density integration: Helical hydrogen-bonded chains, multi-mode switching, and proton synaptic transistorsRen, Yangyang ; Wu, MenghaoThe Journal of chemical physics, 2021-01, Vol.154 (4), p.044705-044705 [Periódico revisado por pares]United States: American Institute of PhysicsTexto completo disponível |
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3 |
Material Type: Artigo
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0D-2D heterostructures as nanocatalysts for self-oscillating reactions: an investigation into chemical kineticsKumar, D. Jaya Prasanna ; Reddy, K. Reshma ; Dayal, PratyushPhysical chemistry chemical physics : PCCP, 2020-11, Vol.22 (42), p.24516-24525 [Periódico revisado por pares]Cambridge: Royal Society of ChemistryTexto completo disponível |
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4 |
Material Type: Artigo
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1–0, 2–0, 3–0, Absorption Bands of Dense Forms of Pure CO and Its Solutions in N2 and ArVu, H. ; Atwood, M. R. ; Vodar, B.The Journal of chemical physics, 1963-01, Vol.38 (11), p.2671-2677 [Periódico revisado por pares]Texto completo disponível |
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5 |
Material Type: Artigo
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1.064 μm multiphoton laser-induced fluorescence and dissociation of tetrakis-(dimethylamino) titanium (IV)Matti Maricq, M. ; Narula, Chaitanya K.Chemical physics letters, 1991-12, Vol.187 (3), p.220-226 [Periódico revisado por pares]Amsterdam: Elsevier B.VTexto completo disponível |
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6 |
Material Type: Artigo
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1.1.1 electrostatic description of molecular systemsRico, J. Fernández ; Alvárez-Collado, J.R. ; Paniagua, M.Molecular physics, 1985-12, Vol.56 (5), p.1145-1155 [Periódico revisado por pares]London: Taylor & Francis GroupTexto completo disponível |
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7 |
Material Type: Artigo
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1,1,1-Trichloroethane-bound cytochrome P450cam dynamics. Does active site water make a difference?Manchester, John I. ; Paulsen, Mark D. ; Rein, Robert ; Ornstein, Rick L.Chemical physics, 1996-04, Vol.204 (2-3), p.223-231 [Periódico revisado por pares]Texto completo disponível |
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8 |
Material Type: Artigo
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1,1,1,2-tetrafluoroethane photofragmentation: a translational kinetic energy release analysis in the EUV and X-ray energies rangeBonfim, Víctor S. A. ; Prazeres, Italo ; Morcelle, Viviane ; Marinho, Ricardo R. T. ; Arruda, Manuela S. ; Mendes, Luiz A. V. ; Ribeiro, Leonardo C. ; Santos, Mabele J. ; Medina, Aline ; Santos, Antônio C. F.Molecular physics, 2022-07, Vol.120 (14) [Periódico revisado por pares]Abingdon: Taylor & FrancisTexto completo disponível |
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9 |
Material Type: Artigo
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1,1,2,2-Tetracyanocyclopropane (TCCP) as supramolecular synthonBauzá, Antonio ; Frontera, Antonio ; Mooibroek, Tiddo JPhysical chemistry chemical physics : PCCP, 2016-01, Vol.18 (3), p.1693-1698 [Periódico revisado por pares]EnglandTexto completo disponível |
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10 |
Material Type: Artigo
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1(1)B(u) (S2) and 2(1)A(g) (S1) fluorescence and the 2(1)A(g) state of alpha,omega-dithienylbutadiene and alpha,omega-dithienylethyleneItoh, Takao ; Yamaji, MinoruThe journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2008-12, Vol.112 (51), p.13413-13418 [Periódico revisado por pares]United StatesTexto completo disponível |