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Chemistry

D-Index
86
Citations
24870
World Ranking
2564
National Ranking
897

Physics

D-Index
86
Citations
24749
World Ranking
2539
National Ranking
1259

Research.com Recognitions

  • 1997 - Fellow of the American Association for the Advancement of Science (AAAS)
  • 1991 - Fellow of American Physical Society (APS) Citation For the extensive contributions to the theory of unimolecular and intramolecular dynamics, variational transition state theory, and the classical trajectory approach for studying chemical reaction dynamics

Overview

William L. Hase is affiliated with Texas Tech University in the United States. Their research spans significant areas in chemistry and physics, emphasizing chemical reaction dynamics and spectroscopy.

The scientist has contributed to several recent publications, including:

  • The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry, 2020, The Journal of Chemical Physics
  • Nonstatistical Reaction Dynamics, 2020, Annual Review of Physical Chemistry
  • Dynamics of Pyrene-Dimer Association and Ensuing Pyrene-Dimer Dissociation, 2020, The Journal of Physical Chemistry A
  • Theoretical Study of the Dynamics of the HBr+ + CO2 → HOCO+ + Br Reaction, 2020, The Journal of Physical Chemistry A
  • Exploring reactivity and product formation in N(4S) collisions with pristine and defected graphene with direct dynamics simulations, 2020, The Journal of Chemical Physics

The frequent co-authors collaborating with William L. Hase include:

  • Bhumika Jayee
  • L. Sandhiya
  • Reed Nieman
  • Riccardo Spezia
  • Yuxuan Yao

The scientist's work is often published in several key venues:

  • The Journal of Physical Chemistry A
  • The Journal of Chemical Physics
  • Physical Chemistry Chemical Physics
  • Annual Review of Physical Chemistry
  • ACS Omega

William L. Hase's main fields of study encompass:

  • Physics and Astronomy
  • Chemistry

Their subfields of study include:

  • Atomic and Molecular Physics, and Optics
  • Spectroscopy
  • Atmospheric Science
  • Materials Chemistry
  • Organic Chemistry

The primary topics of research focus on:

  • Advanced Chemical Physics Studies
  • Spectroscopy and Quantum Chemical Studies
  • Atmospheric chemistry and aerosols
  • Mass Spectrometry Techniques and Applications
  • Spectroscopy and Laser Applications
  • Catalysis and Oxidation Reactions
  • Diamond and Carbon-based Materials Research

William L. Hase has been recognized with the following awards:

  • Fellow of the American Association for the Advancement of Science (AAAS), 1997
  • Fellow of American Physical Society (APS), 1991, with citation for contributions to the theory of unimolecular and intramolecular dynamics, variational transition state theory, and the classical trajectory approach for studying chemical reaction dynamics

Best Publications

  • Unimolecular reaction dynamics : theory and experiments

    Tomas Baer;William L. Hase

  • Vectorization of the general Monte Carlo classical trajectory program VENUS

    Xiche Hu;William L. Hase;Tony Pirraglia

  • A SN2 Reaction That Avoids Its Deep Potential Energy Minimum

    Lipeng Sun;Kihyung Song;William L. Hase

  • On non‐RRKM unimolecular kinetics: Molecules in general, and CH3NC in particular

    Don L. Bunker;W. L. Hase

  • Simulations of Gas-Phase Chemical Reactions: Applications to SN2 Nucleophilic Substitution.

    William L. Hase

  • Ab initio classical trajectories on the Born–Oppenheimer surface: Hessian-based integrators using fifth-order polynomial and rational function fits

    John M. Millam;Vebjo;rn Bakken;Wei Chen

  • Imaging nucleophilic substitution dynamics.

    J. Mikosch;J. Mikosch;S. Trippel;S. Trippel;C. Eichhorn;C. Eichhorn;R. Otto;R. Otto

  • Monte Carlo Sampling for Classical Trajectory Simulations

    Gilles H. Peslherbe;Haobin Wang;William L. Hase

  • Ab initio classical trajectory study of H2CO+H2 + CO dissociation

    Wei Chen;William L. Hase;H.Bernhard Schlegel

  • Variational unimolecular rate theory

    William L. Hase

  • A simple model for correcting the zero point energy problem in classical trajectory simulations of polyatomic molecules

    William H. Miller;William L. Hase;Cynthia L. Darling

  • Theoretical and computational studies of non-RRKM unimolecular dynamics.

    Upakarasamy Lourderaj;William L. Hase

  • Chemical dynamics simulations of X- + CH3Y → XCH3 + Y- gas-phase S(N)2 nucleophilic substitution reactions. Nonstatistical dynamics and nontraditional reaction mechanisms.

    Paranjothy Manikandan;Jiaxu Zhang;William L Hase

  • DIRECT DYNAMICS SIMULATIONS OF REACTIVE SYSTEMS

    Kim Bolton;William L. Hase;Gilles H. Peslherbe

  • Ab Initio Study of the Interaction of Water with Cluster Models of the Aluminum Terminated (0001) α-Aluminum Oxide Surface

    J. M. Wittbrodt;W. L. Hase;H. B. Schlegel

  • Trajectory studies of SN2 nucleophilic substitution. II. Nonstatistical central barrier recrossing in the Cl−+CH3Cl system

    Young June Cho;Scott R. Vande Linde;Ling Zhu;William L. Hase

  • Rethinking the SN2 reaction

    Jing Xie;William L. Hase

  • Trajectory studies of SN2 nucleophilic substitution. I. Dynamics of Cl−+CH3Cl reactive collisions

    Scott R. Vande Linde;William L. Hase

  • On the dynamics of state selected unimolecular reactions: Chloroacetylene dissociation and predissociation

    Christine S. Sloane;William L. Hase

  • Born–Oppenheimer Direct Dynamics Classical Trajectory Simulations

    Lipeng Sun;William L. Hase

  • Some Recent Advances and Remaining Questions Regarding Unimolecular Rate Theory

    William L. Hase

Frequent Co-Authors

Adelia J. A. Aquino
Adelia J. A. Aquino Texas Tech University
Hans Lischka
Hans Lischka Texas Tech University
H. Bernhard Schlegel
H. Bernhard Schlegel Wayne State University
Tomas Baer
Tomas Baer University of North Carolina at Chapel Hill
Vipin Chaudhary
Vipin Chaudhary University at Buffalo, State University of New York
Marie-Pierre Gaigeot
Marie-Pierre Gaigeot University of Évry Val d'Essonne
David B. Cordes
David B. Cordes University of St Andrews
Hua Guo
Hua Guo University of New Mexico
Reinhard Schinke
Reinhard Schinke Max Planck Society
Scott L. Anderson
Scott L. Anderson University of Utah

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