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Semiclassical approximations for the calculation of thermal rate constants for chemical reactions in complex molecular systems
Semiclassical approximations for the calculation of thermal rate constants for chemical reactions in complex molecular systems
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Semiclassical approximations for the calculation of thermal rate constants for chemical reactions in complex molecular systems

Wang, Haobin ; Sun, Xiong ; Miller, William H.

The Journal of chemical physics, 1998-06, Vol.108 (23), p.9726-9736 [Periódico revisado por pares]

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12
Erratum: “Frequency-stabilized cavity ring-down spectroscopy measurements of line mixing and collision induced absorption in the O2 A -band” [J. Chem. Phys. 137, 014307 (2012)]
Erratum: “Frequency-stabilized cavity ring-down spectroscopy measurements of line mixing and collision induced absorption in the O2 A -band” [J. Chem. Phys. 137, 014307 (2012)]
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Erratum: “Frequency-stabilized cavity ring-down spectroscopy measurements of line mixing and collision induced absorption in the O2 A -band” [J. Chem. Phys. 137, 014307 (2012)]

Long, D. A. ; Robichaud, D. J. ; Hodges, J. T.

The Journal of chemical physics, 2012-07, Vol.137 (4) [Periódico revisado por pares]

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13
Interfacing relativistic and nonrelativistic methods. I. Normalized elimination of the small component in the modified Dirac equation
Interfacing relativistic and nonrelativistic methods. I. Normalized elimination of the small component in the modified Dirac equation
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Interfacing relativistic and nonrelativistic methods. I. Normalized elimination of the small component in the modified Dirac equation

Dyall, Kenneth G.

The Journal of chemical physics, 1997-06, Vol.106 (23), p.9618-9626 [Periódico revisado por pares]

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14
Initial reduction of the NiO(100) surface in hydrogen
Initial reduction of the NiO(100) surface in hydrogen
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Initial reduction of the NiO(100) surface in hydrogen

Xu, Qiang ; Cheah, Singfoong ; Zhao, Yufeng

The Journal of chemical physics, 2013-07, Vol.139 (2), p.024704-024704 [Periódico revisado por pares]

United States

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15
The development of effective classical potentials and the quantum statistical mechanical second virial coefficient of water
The development of effective classical potentials and the quantum statistical mechanical second virial coefficient of water
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The development of effective classical potentials and the quantum statistical mechanical second virial coefficient of water

Schenter, Gregory K.

The Journal of chemical physics, 2002-10, Vol.117 (14), p.6573-6581 [Periódico revisado por pares]

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16
Semiclassical study of electronically nonadiabatic dynamics in the condensed-phase: Spin-boson problem with Debye spectral density
Semiclassical study of electronically nonadiabatic dynamics in the condensed-phase: Spin-boson problem with Debye spectral density
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Semiclassical study of electronically nonadiabatic dynamics in the condensed-phase: Spin-boson problem with Debye spectral density

Wang, Haobin ; Song, Xueyu ; Chandler, David ; Miller, William H.

The Journal of chemical physics, 1999-03, Vol.110 (10), p.4828-4840 [Periódico revisado por pares]

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17
Self-assembled ordered polymer nanocomposites directed by attractive particles
Self-assembled ordered polymer nanocomposites directed by attractive particles
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Self-assembled ordered polymer nanocomposites directed by attractive particles

Knorowski, C D ; Anderson, J A ; Travesset, A

The Journal of chemical physics, 2008-04, Vol.128 (16), p.164903-164903 [Periódico revisado por pares]

United States

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18
Spectral projection approach to the quantum scattering calculations
Spectral projection approach to the quantum scattering calculations
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Spectral projection approach to the quantum scattering calculations

Mandelshtam, Vladimir A. ; Taylor, Howard S.

The Journal of chemical physics, 1995-05, Vol.102 (19), p.7390-7399 [Periódico revisado por pares]

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19
On the semiclassical description of quantum coherence in thermal rate constants
On the semiclassical description of quantum coherence in thermal rate constants
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On the semiclassical description of quantum coherence in thermal rate constants

Sun, Xiong ; Wang, Haobin ; Miller, William H.

The Journal of chemical physics, 1998-09, Vol.109 (11), p.4190-4200 [Periódico revisado por pares]

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20
A low-storage filter diagonalization method for quantum eigenenergy calculation or for spectral analysis of time signals
A low-storage filter diagonalization method for quantum eigenenergy calculation or for spectral analysis of time signals
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A low-storage filter diagonalization method for quantum eigenenergy calculation or for spectral analysis of time signals

Mandelshtam, Vladimir A. ; Taylor, Howard S.

The Journal of chemical physics, 1997-03, Vol.106 (12), p.5085-5090 [Periódico revisado por pares]

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Deste Autor:

  1. Coutinho, K
  2. Canuto, S
  3. Fonseca, T
  4. Georg, H
  5. Zerner, M

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  1. Physics
  2. Chemistry
  3. Physics, Atomic, Molecular & Chemical
  4. Physical Sciences
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