Marcel H. F. Sluiter

Overview

Best Publications

• Charting the complete elastic properties of inorganic crystalline compounds

  Maarten de Jong;Wei Chen;Thomas Angsten;Anubhav Jain

  1067
  Citations

• First principles based design and experimental evidence for a ZnO-based ferromagnet at room temperature.

  Marcel H. F. Sluiter;Y. Kawazoe;Parmanand Sharma;A. Inoue

  563
  Citations

• Cluster expansion method for adsorption: Application to hydrogen chemisorption on graphene

  Marcel H. F. Sluiter;Yoshiyuki Kawazoe

  328
  Citations

• Stable geometries and magnetic properties of single-walled carbon nanotubes doped with 3d transition metals: A first-principles study

  Yosuke Yagi;Tina Marie Briere;Marcel H.F. Sluiter;Vijay Kumar

  304
  Citations

• Impurity diffusion activation energies in Al from first principles

  Darko Simonovic;Marcel H. F. Sluiter

  187
  Citations

• Phonon broadening in high entropy alloys

  Fritz Körmann;Yuji Ikeda;Blazej Grabowski;Marcel H. F. Sluiter

  187
  Citations

• First-principles calculation of phase equilibria in the aluminum lithium system.

  M. Sluiter;D. De Fontaine;X. Q. Guo;R. Podloucky

  186
  Citations

• Phase stability and structural relations of nanometer-sized, matrix-embedded precipitate phases in Al-Mg-Si alloys in the late stages of evolution

  M.A. van Huis;J.H. Chen;H.W. Zandbergen;M.H.F. Sluiter

  185
  Citations

• Phase stability and structural features of matrix-embedded hardening precipitates in Al-Mg-Si alloys in the early stages of evolution

  M.A. van Huis;J.H. Chen;M.H.F. Sluiter;H.W. Zandbergen

  165
  Citations

• First-Principles Calculation of the Pressure Dependence of Phase Equilibria in the Al-Li System

  Marcel H. F. Sluiter;Y. Watanabe;D. de Fontaine;Y. Kawazoe

  155
  Citations

• First-principles phase-stability study of fcc alloys in the Ti-Al system.

  Mark Asta;Mark Asta;Didier de Fontaine;Didier de Fontaine;Mark van Schilfgaarde;Marcel Sluiter

  154
  Citations

• Ab initio calculation of the phase stability in Au-Pd and Ag-Pt alloys

  Marcel H. F. Sluiter;C. Colinet;Alain Pasturel

  151
  Citations

• First-principles study of phase stability in Cu-Zn substitutional alloys.

  P. E. A. Turchi;M. Sluiter;F. J. Pinski;Duane D. Johnson

  131
  Citations

• Long-ranged interactions in bcc NbMoTaW high-entropy alloys

  Fritz Körmann;Andrei V. Ruban;Marcel H.F. Sluiter

  130
  Citations

• Phase diagram and low-temperature behavior of oxygen ordering in YBa 2 Cu 3 O z using ab initio interactions

  G. Ceder;M. Asta;W. C. Carter;M. Kraitchman

  128
  Citations

• Ab initio lattice stabilities of some elemental complex structures

  M.H.F. Sluiter

  119
  Citations

• On the mechanism of grain refinement in Al-Zr-Ti alloys

  T.V. Atamanenko;D.G. Eskin;M. Sluiter;L. Katgerman

  111
  Citations

• “Treasure maps” for magnetic high-entropy-alloys from theory and experiment

  Fritz Körmann;Duancheng Ma;Dustin D. Belyea;Matthew S. Lucas

  110
  Citations

• Nano-Indentation Hardness and Elastic Moduli of Bulk Single-Crystal AlN

  Ichiro Yonenaga;Toshiyuki Shima;Marcel H. F. Sluiter

  109
  Citations

• First-principles analysis of solute diffusion in dilute bcc Fe- X alloys

  C. D. Versteylen;N. H. van Dijk;M. H. F. Sluiter

  106
  Citations

• Structural and dynamic evolution in liquid Au-Si eutectic alloy by ab initio molecular dynamics

  A. Pasturel;A. Pasturel;Emre S. Tasci;Marcel H. F. Sluiter;N. Jakse

  104
  Citations

• Origin of predominance of cementite among iron carbides in steel at elevated temperature.

  C. M. Fang;M. H. F. Sluiter;M. A. van Huis;M. A. van Huis;C. K. Ande

  103
  Citations

• Charting the complete elastic properties of inorganic crystalline

  Wei Chen;Thomas Angsten;Anubhav Jain;Randy Notestine

  0
  Citations