Michael J. Mehl

Research.com Recognitions

• 1999 - Fellow of American Physical Society (APS) Citation For outstanding contributions to the development of density functional theory and to its applications using the LAPW method, tightbinding Hamiltonians and methods based on localized charge densities

Overview

Best Publications

• Structural stability and lattice defects in copper: Ab initio , tight-binding, and embedded-atom calculations

  Y. Mishin;M. J. Mehl;D. A. Papaconstantopoulos;A. F. Voter

  2575
  Citations

• Interatomic potentials for monoatomic metals from experimental data and ab initio calculations

  Y. Mishin;Diana Farkas;M. J. Mehl;D. A. Papaconstantopoulos

  1807
  Citations

• AFLOW: An automatic framework for high-throughput materials discovery

  Stefano Curtarolo;Wahyu Setyawan;Gus L Hart;Michal Jahnatek

  1464
  Citations

• Bright triplet excitons in caesium lead halide perovskites

  Michael A. Becker;Michael A. Becker;Roman Vaxenburg;Georgian Nedelcu;Georgian Nedelcu;Peter C. Sercel

  1005
  Citations

• Applications of a tight-binding total-energy method for transition and noble metals: Elastic constants, vacancies, and surfaces of monatomic metals

  Michael J. Mehl;Dimitrios A. Papaconstantopoulos

  790
  Citations

• Structural properties of ordered high-melting-temperature intermetallic alloys from first-principles total-energy calculations

  M. J. Mehl;J. E. Osburn;D. A. Papaconstantopoulos;B. M. Klein

  503
  Citations

• Easily Implementable Nonlocal Exchange-Correlation Energy Functional

  David C. Langreth;M. J. Mehl

  442
  Citations

• Embedded-atom potential for B2-NiAl

  Y. Mishin;M. J. Mehl;D. A. Papaconstantopoulos

  416
  Citations

• Phase stability in the Fe–Ni system: Investigation by first-principles calculations and atomistic simulations

  Y. Mishin;M.J. Mehl;D.A. Papaconstantopoulos;D.A. Papaconstantopoulos

  401
  Citations

• The AFLOW standard for high-throughput materials science calculations

  Camilo E. Calderon;Jose J. Plata;Cormac Toher;Corey Oses

  381
  Citations

• Tight-binding total-energy method for transition and noble metals

  Ronald E. Cohen;Michael J. Mehl;Dimitrios A. Papaconstantopoulos

  316
  Citations

• The AFLOW Library of Crystallographic Prototypes: Part 1

  Michael J. Mehl;David Hicks;Cormac Toher;Ohad Levy

  251
  Citations

• Linearized augmented plane wave electronic structure calculations for MgO and CaO

  M. J. Mehl;R. E. Cohen;H. Krakauer

  208
  Citations

• Electronic structure calculations of lead chalcogenides PbS, PbSe, PbTe

  Mohammed Lach-hab;Dimitrios A. Papaconstantopoulos;Dimitrios A. Papaconstantopoulos;Michael J. Mehl

  207
  Citations

• Potential-induced breathing model for the elastic moduli and high-pressure behavior of the cubic alkaline-earth oxides

  M. J. Mehl;R. J. Hemley;L. L. Boyer

  201
  Citations

• Calculated elastic and thermal properties of MGO at high pressures and temperatures

  Donald G. Isaak;Ronald E. Cohen;Michael J. Mehl

  201
  Citations

• Disordered enthalpy–entropy descriptor for high-entropy ceramics discovery

  Unknown

  189
  Citations

• Energetic, vibrational, and electronic properties of silicon using a nonorthogonal tight-binding model

  N. Bernstein;M. J. Mehl;D. A. Papaconstantopoulos;N. I. Papanicolaou

  139
  Citations

• Lattice dynamics of the potential-induced breathing model: Phonon dispersion in the alkaline-earth oxides.

  Ronald E. Cohen;L. L. Boyer;M. J. Mehl

  122
  Citations

• The AFLOW Library of Crystallographic Prototypes: Part 2

  David Hicks;Michael J. Mehl;Eric Gossett;Cormac Toher

  119
  Citations

• Tight-binding study of stacking fault energies and the Rice criterion of ductility in the fcc metals

  Michael J. Mehl;Dimitrios A. Papaconstantopoulos;Nicholas Kioussis;M. Herbranson

  112
  Citations

• High thermal conductivity of a hydrogenated amorphous silicon film.

  Xiao Liu;J. L. Feldman;J. L. Feldman;D. G. Cahill;R. S. Crandall

  102
  Citations