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Chemistry

D-Index
62
Citations
17630
World Ranking
8706
National Ranking
2495

Research.com Recognitions

  • 2017 - Fellow of American Physical Society (APS) Citation For outstanding and diverse application of electronic structure methods in condensed matter and their application, development, and optimization on high performance computers
  • 2008 - ACM Gordon Bell Prize Multi-teraflops Simulations of Disorder Effects on the Transition Temperature of the High Tc Superconducting Cuprates.

Overview

Paul R. C. Kent is affiliated with Oak Ridge National Laboratory in the United States. Their primary field of study is Materials Science, with significant contributions in subfields including Materials Chemistry, Atomic and Molecular Physics and Optics, Electrical and Electronic Engineering, Computer Networks and Communications, and Condensed Matter Physics.

Their research covers a variety of topics with a focus on materials and computational methods. Main topics of their work include:

  • MXene and MAX Phase Materials
  • 2D Materials and Applications
  • Machine Learning in Materials Science
  • Electronic and Structural Properties of Oxides
  • Advanced Chemical Physics Studies
  • Distributed and Parallel Computing Systems
  • Graphene Research and Applications

Notable recent papers authored or co-authored by Paul R. C. Kent include:

  • "Tracking ion intercalation into layered Ti3C2 MXene films across length scales" (2020) published in Energy & Environmental Science
  • "How Water Attacks MXene" (2022) published in Chemistry of Materials
  • "Effects of Surface Terminations of 2D Bi2WO6 on Photocatalytic Hydrogen Evolution from Water Splitting" (2020) published in ACS Applied Materials & Interfaces
  • "Exascale applications: skin in the game" (2020) published in Philosophical Transactions of the Royal Society A Mathematical Physical and Engineering Sciences
  • "Multiscale and Multimodal Characterization of 2D Titanium Carbonitride MXene" (2020) published in Advanced Materials Interfaces

Frequent co-authors collaborating with Paul R. C. Kent include:

  • Jaron T. Krogel
  • Anouar Benali
  • Panchapakesan Ganesh
  • Ye Luo
  • Olle Heinonen

Paul R. C. Kent has published extensively in specific scientific venues, notably:

  • arXiv (Cornell University)
  • Journal of Chemical Theory and Computation
  • The Journal of Chemical Physics
  • Physical Review B
  • Scientific Reports

The scientist has received professional recognition in the form of awards, including:

  • Fellow of American Physical Society (APS) in 2017, cited for outstanding and diverse application of electronic structure methods in condensed matter and their application, development, and optimization on high performance computers
  • ACM Gordon Bell Prize in 2008 for multi-teraflops simulations of disorder effects on the transition temperature of high Tc superconducting cuprates

Best Publications

  • Two-Dimensional, Ordered, Double Transition Metals Carbides (MXenes)

    Babak Anasori;Yu Xie;Majid Beidaghi;Jun Lu

  • Role of Surface Structure on Li-Ion Energy Storage Capacity of Two-Dimensional Transition-Metal Carbides

    Yu Xie;Michael Naguib;Vadym N. Mochalin;Michel W. Barsoum

  • Atomic Defects in Monolayer Titanium Carbide (Ti3C2Tx) MXene

    Xiahan Sang;Yu Xie;Ming Wei Lin;Mohamed Alhabeb

  • Prediction and Characterization of MXene Nanosheet Anodes for Non-Lithium-Ion Batteries

    Yu Xie;Yohan Dall’Agnese;Yohan Dall’Agnese;Michael Naguib;Yury Gogotsi

  • Hybrid density functional study of structural and electronic properties of functionalized Ti n+1 X n (X=C, N) monolayers

    Yu Xie;Paul R Kent

  • Control of electronic properties of 2D carbides (MXenes) by manipulating their transition metal layers

    Babak Anasori;Chenyang Shi;Eun Ju Moon;Yu Xie

  • Strong anisotropy and magnetostriction in the two-dimensional Stoner ferromagnet Fe 3 GeTe 2

    Houlong L. Zhuang;Houlong L. Zhuang;Paul R. C. Kent;Richard G. Hennig

  • Thermodynamic properties of PbTe, PbSe, and PbS: First-principles study

    Yi Zhang;Xuezhi Ke;Xuezhi Ke;Changfeng Chen;Jihui Yang

  • Understanding the MXene Pseudocapacitance

    Cheng Zhan;Michael Naguib;Maria R Lukatskaya;Paul R C Kent

  • Deciphering chemical order/disorder and material properties at the single-atom level

    Yongsoo Yang;Chien Chun Chen;Chien Chun Chen;M. C. Scott;M. C. Scott;Colin Ophus

  • Systematic study of d-wave superconductivity in the 2D repulsive Hubbard model.

    T. A. Maier;M. Jarrell;T. C. Schulthess;P. R. C. Kent

  • Evolution of III-V nitride alloy electronic structure: the localized to delocalized transition.

    P. R. C. Kent;Alex Zunger

  • Effect of Metal Ion Intercalation on the Structure of MXene and Water Dynamics on its Internal Surfaces.

    Naresh C. Osti;Michael Naguib;Alireza Ostadhossein;Yu Xie

  • Ultrathin nanosheets of CrSiTe3: a semiconducting two-dimensional ferromagnetic material

    Ming Wei Lin;Houlong L. Zhuang;Jiaqiang Yan;Jiaqiang Yan;Thomas Zac Ward

  • Computational discovery of ferromagnetic semiconducting single-layer CrSnTe 3

    Houlong L. Zhuang;Yu Xie;P. R. C. Kent;P. Ganesh

  • Itinerant Antiferromagnetism in RuO_{2}.

    Tom Berlijn;Paul C. Snijders;Paul C. Snijders;Oliver A. Delaire;Oliver A. Delaire;H. D. Zhou

  • Competitive lithium solvation of linear and cyclic carbonates from quantum chemistry

    Oleg Borodin;Marco Olguin;P. Ganesh;Paul R. C. Kent

  • Multimodality of Structural, Electrical, and Gravimetric Responses of Intercalated MXenes to Water

    Eric S. Muckley;Michael Naguib;Hsiu-Wen Wang;Lukas Vlcek

  • Computational Insights into Materials and Interfaces for Capacitive Energy Storage.

    Cheng Zhan;Cheng Lian;Cheng Lian;Yu Zhang;Matthew W. Thompson

  • In situ atomistic insight into the growth mechanisms of single layer 2D transition metal carbides

    Xiahan Sang;Yu Xie;Dundar E. Yilmaz;Roghayyeh Lotfi

  • Understanding the origin of high-rate intercalation pseudocapacitance in Nb2O5 crystals

    Andrew A. Lubimtsev;Andrew A. Lubimtsev;Paul R. C. Kent;Bobby G. Sumpter;P. Ganesh

  • Two-dimensional, ordered, double transition metals carbides (MXenes)

    Paul Kent;Babak Anasori;Yu Xie;Majid Beidaghi

Frequent Co-Authors

Yury Gogotsi
Yury Gogotsi Drexel University
James D. Kubicki
James D. Kubicki The University of Texas at El Paso
De-en Jiang
De-en Jiang Vanderbilt University
David J. Wesolowski
David J. Wesolowski Oak Ridge National Laboratory
Houlong L. Zhuang
Houlong L. Zhuang Arizona State University
Alex Zunger
Alex Zunger University of Colorado Boulder
Michael Naguib
Michael Naguib Tulane University
Bobby G. Sumpter
Bobby G. Sumpter Oak Ridge National Laboratory
Valentino R. Cooper
Valentino R. Cooper Oak Ridge National Laboratory
Jihui Yang
Jihui Yang University of Washington

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