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Electronic Origins of Anomalous Twin Boundary Energies in Hexagonal Close Packed Transition Metals

Physical review letters, 2015-08, Vol.115 (6), p.065501-065501, Article 065501

2015

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

Applied physics letters, 2015-10, Vol.107 (14)

2015

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Modelling the formation and self-healing of creep damage in iron-based alloys

Journal of materials science, 2018-10, Vol.53 (20), p.14758-14773

2018

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Origin of Predominance of Cementite among Iron Carbides in Steel at Elevated Temperature

Physical review letters, 2010-07, Vol.105 (5), p.055503-055503, Article 055503

2010

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

Acta materialia, 2006-06, Vol.54 (11), p.2945-2955

2006

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Brute Force Composition Scanning with a CALPHAD Database to Find Low Temperature Body Centered Cubic High Entropy Alloys

Entropy (Basel, Switzerland), 2018-11, Vol.20 (12), p.911

2018

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

Acta materialia, 2007-04, Vol.55 (6), p.2183-2199

2007

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Lattice stability prediction of elemental tetrahedrally close-packed structures

Acta materialia, 2007-06, Vol.55 (11), p.3707-3718

Sluiter, M.H.F.

2007

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

Physical review. B, 2017-09, Vol.96 (9), Article 094105

2017

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Stability, structure and electronic properties of γ-Fe23C6 from first-principles theory

Acta materialia, 2010-05, Vol.58 (8), p.2968-2977

2010

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Atomistic structure and strain relaxation in Czochralski-grown SixGe1-x bulk alloys

Journal of materials science. Materials in electronics, 2005-07, Vol.16 (7), p.429-432

2005

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Diffusion of carbon in bcc Fe in the presence of Si

Physical review. B, Condensed matter and materials physics, 2010-02, Vol.81 (5), Article 054116

2010

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Using first-principles results to calculate finite-temperature thermodynamic properties of the Nb-Ni μ phase in the Bragg-Williams approximation

Philosophical magazine (Abingdon, England), 2006-04, Vol.86 (12), p.1631-1641

2006

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Molecular dynamics simulation of graphene on Cu (100) and (111) surfaces

Carbon (New York), 2015-02, Vol.82, p.538-547

2015

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Prediction of the mixing enthalpy of alloys

Europhysics letters, 2002-02, Vol.57 (4), p.526-532

2002

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Ab initio lattice stabilities of some elemental complex structures

Calphad, 2006-12, Vol.30 (4), p.357-366

Sluiter, M.H.F.

2006

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Homologous series of layered structures in binary and ternary Bi-Sb-Te-Se systems: Ab initio study

Physical review. B, Condensed matter and materials physics, 2014-02, Vol.89 (5), Article 054106

2014

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Cluster expansion of electronic excitations: application to fcc Ni-Al alloys

The Journal of chemical physics, 2005-06, Vol.122 (21), p.214706-214706

2005

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Depth dependence of vacancy formation energy at (100), (110), and (111) Al surfaces: A first-principles study

Physical review. B, 2016-02, Vol.93 (8), Article 085432

2016

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DFT Study of 1,3-Dimethylimidazolium Tetrafluoroborate on Al and Cu(111) Surfaces

Journal of physical chemistry. C, 2011-08, Vol.115 (30), p.14718-14730

2011

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Formation and growth of transition metal carbides in ferrite

Computational materials science, 2024-06, Vol.242, p.113097, Article 113097

2024

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Direct observation and modeling of growth-induced stacking fault in chromium-rich γ-M23C6 carbides

Scripta materialia, 2020-03, Vol.178, p.290-294

2020

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Atomistic simulation of carbide formation in ferrite

Computational materials science, 2023-10, Vol.230, p.112455, Article 112455

2023

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Some observed bcc, fcc, and hcp superstructures

Phase transitions, 2007-04, Vol.80 (4-5), p.299-309

Sluiter, M. H. F.

2007

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Stability, geometry and electronic properties of BH n (n = 0 to 3) radicals on the Si{0 0 1}3 × 1:H surface from first-principles

Journal of physics. Condensed matter, 2020-05, Vol.32 (23), p.235201-235201

2020

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Electronic Origins of Anomalous Twin Boundary Energies in Hexagonal Close Packed Transition Metals

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

Modelling the formation and self-healing of creep damage in iron-based alloys

Origin of Predominance of Cementite among Iron Carbides in Steel at Elevated Temperature

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

Brute Force Composition Scanning with a CALPHAD Database to Find Low Temperature Body Centered Cubic High Entropy Alloys

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

Lattice stability prediction of elemental tetrahedrally close-packed structures

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

Stability, structure and electronic properties of γ-Fe23C6 from first-principles theory

Atomistic structure and strain relaxation in Czochralski-grown SixGe1-x bulk alloys

Diffusion of carbon in bcc Fe in the presence of Si

Using first-principles results to calculate finite-temperature thermodynamic properties of the Nb-Ni μ phase in the Bragg-Williams approximation

Molecular dynamics simulation of graphene on Cu (100) and (111) surfaces

Prediction of the mixing enthalpy of alloys

Ab initio lattice stabilities of some elemental complex structures

Homologous series of layered structures in binary and ternary Bi-Sb-Te-Se systems: Ab initio study

Cluster expansion of electronic excitations: application to fcc Ni-Al alloys

Depth dependence of vacancy formation energy at (100), (110), and (111) Al surfaces: A first-principles study

DFT Study of 1,3-Dimethylimidazolium Tetrafluoroborate on Al and Cu(111) Surfaces

Formation and growth of transition metal carbides in ferrite

Direct observation and modeling of growth-induced stacking fault in chromium-rich γ-M23C6 carbides

Atomistic simulation of carbide formation in ferrite

Some observed bcc, fcc, and hcp superstructures

Stability, geometry and electronic properties of BH n (n = 0 to 3) radicals on the Si{0 0 1}3 × 1:H surface from first-principles

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