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1 |
Material Type: Artigo
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Molecular model for aqueous ferrous-ferric electron transferKUHARSKI, R. A ; BADER, J. S ; CHANDLER, D ; SPRIK, M ; KLEIN, M. L ; INPEY, R. WJ. Chem. Phys.; (United States), 1988-09, Vol.89 (5), p.3248-3257 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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Quantum reactive scattering in three dimensions using hyperspherical (APH) coordinates. TheoryPACK, R. T ; PARKER, G. AJ. Chem. Phys.; (United States), 1987-10, Vol.87 (7), p.3888-3921 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
3 |
Material Type: Artigo
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Structure, stability, and fragmentation of small carbon clustersRAGHAVACHARI, K ; BINKLEY, J. SJ. Chem. Phys.; (United States), 1987-08, Vol.87 (4), p.2191-2197 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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Local modes of benzene and benzene dimer, studied by infrared-ultraviolet double resonance in a supersonic beamPAGE, R. H ; SHEN, Y. R ; LEE, Y. TJ. Chem. Phys.; (United States), 1988-04, Vol.88 (8), p.4621-4636 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
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Material Type: Artigo
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Electric field assisted dissociation of charge transfer states as a mechanism of photocarrier productionBRAUN, C. LJ. Chem. Phys.; (United States), 1984-05, Vol.80 (9), p.4157-4161 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
6 |
Material Type: Artigo
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A method to constrain vibrational energy in quasiclassical trajectory calculationsBOWMAN, J. M ; GAZDY, B ; QIYAN SUNJ. Chem. Phys.; (United States), 1989-09, Vol.91 (5), p.2859-2862 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
7 |
Material Type: Artigo
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Quantum mechanical rate constants for bimolecular reactionsMILLER, W. H ; SCHWARTZ, S. D ; TROMP, J. WJ. Chem. Phys.; (United States), 1983-11, Vol.79 (10), p.4889-4898 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
8 |
Material Type: Artigo
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Time-dependent self-consistent field (TDSCF) approximation for a reaction coordinate coupled to a harmonic bath: single and multiple configuration treatmentsMAKRI, N ; MILLER, W. HJ. Chem. Phys.; (United States), 1987-11, Vol.87 (10), p.5781-5787 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
9 |
Material Type: Artigo
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Efficient molecular simulation of chemical potentialsDEITRICK, G. L ; SCRIVEN, L. E ; DAVIS, H. TJ. Chem. Phys.; (United States), 1989-02, Vol.90 (4), p.2370-2385 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |
10 |
Material Type: Artigo
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Reaction surface description of intramolecular hydrogen atom transfer in malonaldehydeCARRINGTON, T. JR ; MILLER, W. HJ. Chem. Phys.; (United States), 1986-04, Vol.84 (8), p.4364-4370 [Periódico revisado por pares]Woodbury, NY: American Institute of PhysicsTexto completo disponível |