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On the effect of alloy composition on martensite start temperatures and latent heats in Ni–Ti-based shape memory alloys

Acta materialia, 2015-05, Vol.90, p.213-231

2015

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TCP phase predictions in Ni-based superalloys: Structure maps revisited

Acta materialia, 2011, Vol.59 (2), p.749-763

2011

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Diffusion of solutes in fcc Cobalt investigated by diffusion couples and first principles kinetic Monte Carlo

Acta materialia, 2016-03, Vol.106, p.304-312

2016

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New superconducting and semiconducting Fe-B compounds predicted with an ab initio evolutionary search

Physical review letters, 2010-11, Vol.105 (21), p.217003-217003, Article 217003

2010

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On the role of Re in the stress and temperature dependence of creep of Ni-base single crystal superalloys

Materials science & engineering. A, Structural materials : properties, microstructure and processing, 2015-03, Vol.628, p.382-395

2015

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Topologically close-packed phases in binary transition-metal compounds: matching high-throughput ab initio calculations to an empirical structure map

New journal of physics, 2013-11, Vol.15 (11), p.115016-18

2013

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Transferability of interatomic potentials for molybdenum and silicon

Modelling and simulation in materials science and engineering, 2019-03, Vol.27 (2), p.25007

2019

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Structural stability of Fe-based topologically close-packed phases

Intermetallics, 2015-04, Vol.59, p.59-67

2015

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Ab initio study of boron in α -iron: Migration barriers and interaction with point defects

Physical review. B, Condensed matter and materials physics, 2013-03, Vol.87 (10), Article 104109

2013

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Ab initio study of the modification of elastic properties of α-iron by hydrostatic strain and by hydrogen interstitials

Acta materialia, 2011-06, Vol.59 (11), p.4255-4263

2011

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A kinetic Monte Carlo approach to diffusion-controlled thermal desorption spectroscopy

Philosophical transactions of the Royal Society of London. Series A: Mathematical, physical, and engineering sciences, 2017-07, Vol.375 (2098), p.20160404-20160404

2017

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Analytic bond-order potentials for the bcc refractory metals Nb, Ta, Mo and W

Journal of physics. Condensed matter, 2014-05, Vol.26 (19), p.195501-195501

2014

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Microsegregation and precipitates of an as-cast Co-based superalloy—microstructural characterization and phase stability modelling

Journal of materials science, 2015-10, Vol.50 (19), p.6329-6338

2015

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Repair of Ni-based single-crystal superalloys using vacuum plasma spray

Materials & design, 2019-04, Vol.168, p.107656, Article 107656

2019

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thermal stability of topologically close-packed phases in the single-crystal Ni-base superalloy ERBO/1

Journal of materials science, 2016-03, Vol.51 (5), p.2653-2664

2016

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Ab-initio study of C and N point defects in the C14-Fe2Nb phase

Journal of alloys and compounds, 2017-02, Vol.693, p.1315-1322

2017

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Spin-cluster expansion: Parametrization of the general adiabatic magnetic energy surface with ab initio accuracy

Physical review. B, Condensed matter and materials physics, 2004-03, Vol.69 (10), Article 104404

2004

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Structure map including off-stoichiometric and ternary sp-d-valent compounds

Modelling and simulation in materials science and engineering, 2017-10, Vol.25 (7), p.74002

2017

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Development of Single-Crystal Ni-Base Superalloys Based on Multi-criteria Numerical Optimization and Efficient Use of Refractory Elements

Metallurgical and materials transactions. A, Physical metallurgy and materials science, 2018-09, Vol.49 (9), p.4134-4145

2018

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Comparison of analytic and numerical bond-order potentials for W and Mo

Journal of physics. Condensed matter, 2013-07, Vol.25 (26), p.265002-265002

2013

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Possible routes for synthesis of new boron-rich Fe–B and Fe1−xCrxB4 compounds

Applied physics letters, 2011-02, Vol.98 (8)

2011

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Study of grain boundary self-diffusion in iron with different atomistic models

Acta materialia, 2020-04, Vol.188, p.560-569

2020

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Structure and magnetism in bcc-based iron-cobalt alloys

Physical review. B, Condensed matter and materials physics, 2006-06, Vol.73 (22), Article 224208

2006

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Ab initio study of the interaction of H with substitutional solute atoms in α-Fe: Trends across the transition-metal series

Computational materials science, 2012-12, Vol.65, p.235-238

2012

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Off-stoichiometric softening and polytypic transformations in the plastic deformation of the C14 Fe 2 Nb Laves phase

Acta materialia, 2023-11, Vol.260, p.119326, Article 119326

2023

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On the effect of alloy composition on martensite start temperatures and latent heats in Ni–Ti-based shape memory alloys

TCP phase predictions in Ni-based superalloys: Structure maps revisited

Diffusion of solutes in fcc Cobalt investigated by diffusion couples and first principles kinetic Monte Carlo

New superconducting and semiconducting Fe-B compounds predicted with an ab initio evolutionary search

On the role of Re in the stress and temperature dependence of creep of Ni-base single crystal superalloys

Topologically close-packed phases in binary transition-metal compounds: matching high-throughput ab initio calculations to an empirical structure map

Transferability of interatomic potentials for molybdenum and silicon

Structural stability of Fe-based topologically close-packed phases

Ab initio study of boron in α -iron: Migration barriers and interaction with point defects

Ab initio study of the modification of elastic properties of α-iron by hydrostatic strain and by hydrogen interstitials

A kinetic Monte Carlo approach to diffusion-controlled thermal desorption spectroscopy

Analytic bond-order potentials for the bcc refractory metals Nb, Ta, Mo and W

Microsegregation and precipitates of an as-cast Co-based superalloy—microstructural characterization and phase stability modelling

Repair of Ni-based single-crystal superalloys using vacuum plasma spray

thermal stability of topologically close-packed phases in the single-crystal Ni-base superalloy ERBO/1

Ab-initio study of C and N point defects in the C14-Fe2Nb phase

Spin-cluster expansion: Parametrization of the general adiabatic magnetic energy surface with ab initio accuracy

Structure map including off-stoichiometric and ternary sp-d-valent compounds

Development of Single-Crystal Ni-Base Superalloys Based on Multi-criteria Numerical Optimization and Efficient Use of Refractory Elements

Comparison of analytic and numerical bond-order potentials for W and Mo

Possible routes for synthesis of new boron-rich Fe–B and Fe1−xCrxB4 compounds

Study of grain boundary self-diffusion in iron with different atomistic models

Structure and magnetism in bcc-based iron-cobalt alloys

Ab initio study of the interaction of H with substitutional solute atoms in α-Fe: Trends across the transition-metal series

Off-stoichiometric softening and polytypic transformations in the plastic deformation of the C14 Fe 2 Nb Laves phase

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