Concepedia

Thermochemical Kinetics

Thermochemical Kinetics is a theoretical framework that belongs to the class of combustion thermodynamics models, specifically distinguished by its integration of thermodynamic state functions with chemical reaction rate theory to quantitatively describe the time-dependent evolution of reactive systems under non-equilibrium conditions.

1.4K

Publications

127.4K

Citations

4K

Authors

1K

Institutions

Publications per year

2017–2026

330

Parents

Publications

1.4K

The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals

Yan Zhao, Donald G. Truhlar · Theoretical Chemistry Accounts · 2007 · 30K citations · Full text

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A new local density functional for main-group thermochemistry, transition metal bonding, thermochemical kinetics, and noncovalent interactions

Yan Zhao, Donald G. Truhlar · The Journal of Chemical Physics · 2006 · 5.1K citations

, , +17

Design of Density Functionals by Combining the Method of Constraint Satisfaction with Parametrization for Thermochemistry, Thermochemical Kinetics, and Noncovalent Interactions

Yan Zhao, Nathan E. Schultz, Donald G. Truhlar · Journal of Chemical Theory and Computation · 2006 · 3.7K citations

, , +16

Evaluated Kinetic Data for Combustion Modelling

D. L. Baulch, Carlos J. Cobos, R. A. Cox et al. · Journal of Physical and Chemical Reference Data · 1992 · 2.1K citations · Full text

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Design of Density Functionals That Are Broadly Accurate for Thermochemistry, Thermochemical Kinetics, and Nonbonded Interactions

Yan Zhao, Donald G. Truhlar · The Journal of Physical Chemistry A · 2005 · 1.7K citations

, , +17

1–5 of 1.4K

Authors

4K

  1. DG
    Donald G. Truhlar

    University of Minnesota, United States

    16 publications · 46K citations

    16

    h-index

  2. YZ
    Yan Zhao

    Wuhan University of Technology, China

    13 publications · 45.7K citations

    13

    h-index

  3. MA
    Manuel A.V. Ribeiro da Silva

    Universidade do Porto, Portugal

    17 publications · 308 citations

    12

    h-index

  4. HJ
    Henry J. Curran

    Ollscoil na Gaillimhe – University of Galway, Ireland

    11 publications · 2.1K citations

    11

    h-index

  5. ER
    E. Ranzi

    Politecnico di Milano, Italy

    11 publications · 744 citations

    11

    h-index

1–5 of 4K

Institutions

1K

  1. Centre National de la Recherche Scientifique

    Paris, France

    24 h-index

    102 publications

    8K citations

  2. University of Minnesota

    Minneapolis, United States

    21 h-index

    64 publications

    100.6K citations

  3. University of Leeds

    Leeds, United Kingdom

    18 h-index

    59 publications

    14.2K citations

  4. Princeton University

    Princeton, United States

    18 h-index

    48 publications

    9.5K citations

  5. Politecnico di Milano

    Milan, Italy

    17 h-index

    72 publications

    4K citations

  6. Universidade do Porto

    Porto, Portugal

    17 h-index

    97 publications

    2K citations

  7. Massachusetts Institute of Technology

    Cambridge, United States

    16 h-index

    42 publications

    2K citations

  8. RWTH Aachen University

    Aachen, Germany

    16 h-index

    43 publications

    3.2K citations

1–8 of 1K

Venues

  1. Combustion and Flame

    72 publications · 7.1K citations

    42

    h-index

  2. The Journal of Chemical Physics

    45 publications · 9.9K citations

    29

    h-index

  3. Fuel

    40 publications · 1.8K citations

    29

    h-index

  4. The Journal of Physical Chemistry A

    33 publications · 5.9K citations

    26

    h-index

  5. Thermochimica Acta

    TA · 51 publications · 3.3K citations

    25

    h-index

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