Reduced dimensionality transition state theory with multi-dimensional tunnelling

Reduced dimensionality transition state theory with multi-dimensional tunnelling

<p>Full-dimensional quantum reactive scattering (QRS) calculations provide the most accurate dynamical results which include the rate constants for a chemical reaction. However, the computational costs involved in the calculations scale significantly with the size of the reacting system. Tr...

Descrizione completa

Dettagli Bibliografici
Autore principale:	Kwan, Y
Altri autori:	Shan, X
Natura:	Tesi
Pubblicazione:	2016

Documenti analoghi

Tunnelling in cyclocarbenes: an application of Semiclassical Transition State Theory in reduced dimensions
di: Burd, TAH, et al.
Pubblicazione: (2019)

Research on Antenna Propagation Loss Model in Rail Transit Tunnel based on Multi-dimensional Scenario Analysis
di: ZHAO Yifan, et al.
Pubblicazione: (2025-01-01)

Three-dimensional stability analysis of tunnel face based on unified strength theory
di: Qiao Liang, et al.
Pubblicazione: (2023-07-01)

Cell Fate Decision as High-Dimensional Critical State Transition.
di: Mitra Mojtahedi, et al.
Pubblicazione: (2016-12-01)

Performance of wing sail with multi element by two-dimensional wind tunnel investigations
di: Hiroyuki FURUKAWA, et al.
Pubblicazione: (2015-12-01)

Black hole — wormhole transitions in two dimensional string theory
di: Panos Betzios, et al.
Pubblicazione: (2024-05-01)

Theory of the Many-Body Localization Transition in One-Dimensional Systems
di: Ronen Vosk, et al.
Pubblicazione: (2015-09-01)

Spin-mixing-tunneling network model for Anderson transitions in two-dimensional disordered spinful electrons
di: Jie Lu, et al.
Pubblicazione: (2018-01-01)

Probabilistic prediction on three-dimensional roughness of discontinuity based on two-dimensional traces under rock tunnel excavation based on Bayesian theory
di: Qi Zhang, et al.
Pubblicazione: (2024-02-01)

Dimensional phase transitions
di: Jourjine, Alexander
Pubblicazione: (2006)

Tunneling spectroscopy of the two-dimensional electron gas
di: Chan, Ho Bun, 1969-
Pubblicazione: (2005)

Design of two-dimensional wind tunnel contractions /
di: 458091 Morel, Thomas

Multiple and Multi-Dimensional Welfare State Transformations
di: Seeleib-Kaiser, M
Pubblicazione: (2008)

Group theory analysis of phonons in two-dimensional transition metal dichalcogenides
di: Ribeiro-Soares, J., et al.
Pubblicazione: (2014)

Design optimization of three dimensional geometry of wind tunnel contraction
di: A.S. Abdelhamed, et al.
Pubblicazione: (2015-03-01)

Ultrafast state-selective tunneling in two-dimensional semiconductors with a phase- and amplitude-controlled THz-scanning tunneling microscope
di: L. Bobzien, et al.
Pubblicazione: (2024-05-01)

The 2-dimensional to 3-dimensional growth transition in Physcomitrium patens
di: Weeks, Z
Pubblicazione: (2024)

An investigation of one- versus two-dimensional semiclassical transition state theory for H atom abstraction and exchange reactions
di: Greene, S, et al.
Pubblicazione: (2016)

Reduced-Order Modeling of Unsteady Hypersonic Aerodynamics in Multi-Dimensional Parametric Space
di: Z. Chen, et al.
Pubblicazione: (2018-01-01)

A three-dimensional finite element model of tunnelling
di: Augarde, C, et al.
Pubblicazione: (1995)

Three-dimensional finite element analysis of lined tunnels
di: Augarde, C, et al.
Pubblicazione: (2001)

Dephasing–rephasing dynamics of one-dimensional tunneling quasicondensates
di: A Tononi, et al.
Pubblicazione: (2020-01-01)

Tunneling between parallel one-dimensional Wigner crystals
di: R. Méndez-Camacho, et al.
Pubblicazione: (2022-03-01)

Tunnel junctions based on interfacial two dimensional ferroelectrics
di: Yunze Gao, et al.
Pubblicazione: (2024-05-01)

Dimensional Comparison Theory
di: Friederike Helm, et al.
Pubblicazione: (2016-05-01)

Multi-Dimensional Quantum Capacitance of the Two-Site Hubbard Model: The Role of Tunable Interdot Tunneling
di: Andrea Secchi, et al.
Pubblicazione: (2022-12-01)

The Impact of Multi-Dimensional Incentives on the Performance of Rail Transit PPP Projects
di: Zheng Zhu, et al.
Pubblicazione: (2024-12-01)

Low-dimensional organization of global brain states of reduced consciousness
di: Yonatan Sanz Perl, et al.
Pubblicazione: (2023-05-01)

Multi-Criteria Assignment Techniques in Multi-Dimensional Neutrosophic Soft Set Theory
di: Tanushree Mitra Basu, et al.
Pubblicazione: (2017-02-01)

Flow states and transitions of an active nematic in a three-dimensional channel
di: Chandragiri, S, et al.
Pubblicazione: (2020)

Magnetic properties of two-dimensional nanodots: Ground state and phase transition
di: Maciej Kasperski, et al.
Pubblicazione: (2013-12-01)

Optimal Multi-dimensional Mechanism Design: Reducing Revenue to Welfare Maximization
di: Cai, Yang, et al.
Pubblicazione: (2015)

Three-dimensional analysis of surface settlement in soft ground tunneling
di: Greenwood, Jedediah Drury, 1977-
Pubblicazione: (2006)

Magnetooscillations of the tunneling current between two-dimensional electron systems /
di: 463185 Raichev, O. E., et al.
Pubblicazione: (1995)

Three-Dimensional Reconstruction of Tunnel Face Based on Multiple Images
di: Wenge Qiu, et al.
Pubblicazione: (2021-01-01)

Limitation of convergence-confinement method on three-dimensional tunnelling effect
di: Liuming Chang, et al.
Pubblicazione: (2023-02-01)

Quantum tunneling from accelerating three-dimensional black hole
di: Usman A. Gillani, et al.
Pubblicazione: (2022-11-01)

Three-Dimensional Study of Natm Tunneling Near Deep Foundations
di: GholamReza Havaei, et al.
Pubblicazione: (2021-07-01)

Three Dimensional Anatomical Study of Carpal Tunnel (Cadaveric Study)
di: Thamir A. Hamdan, et al.
Pubblicazione: (2002-12-01)

Three-dimensional spatial and temporal distributions of dust in roadway tunneling
di: Haifei Yao, et al.
Pubblicazione: (2020-02-01)