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High-throughput search for caloric materials: the CaloriCool approach

Journal of physics. D, Applied physics, 2018-01, Vol.51 (2), p.24002

2018

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Shape-memory transformations of NiTi: minimum-energy pathways between austenite, martensites, and kinetically limited intermediate states

Physical review letters, 2014-12, Vol.113 (26), p.265701-265701, Article 265701

2014

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Magneto-structural transformations via a solid-state nudged elastic band method: Application to iron under pressure

The Journal of chemical physics, 2015-08, Vol.143 (6), p.064707-064707

2015

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Thermal stability of MnBi magnetic materials

Journal of physics. Condensed matter, 2014-02, Vol.26 (6), p.064212-064212

2014

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Coexistence pressure for a martensitic transformation from theory and experiment: Revisiting the bcc-hcp transition of iron under pressure

Physical review. B, Condensed matter and materials physics, 2015-05, Vol.91 (17), Article 174104

2015

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Controlling magnetostructural transition and magnetocaloric effect in multi-component transition-metal-based materials

Journal of applied physics, 2021-05, Vol.129 (19)

2021

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Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

Journal of applied physics, 2014-05, Vol.115 (17)

2014

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Predicting enthalpies of molecular substances: application to LiBH4

Physical review letters, 2008-02, Vol.100 (4), p.040602-040602

2008

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Structure and stability of hcp bulk and nano-precipitated Ag2Al

Acta materialia, 2002-05, Vol.50 (9), p.2443-2459

2002

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Energy scaling and surface patterning of halogen-terminated Si(0 0 1) surfaces

Surface science, 2005-10, Vol.591 (1), p.L292-L298

2005

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Crossover energetics for halogenated Si(100) : Vacancy line defects, dimer vacancy lines, and atom vacancy lines

Physical review. B, Condensed matter and materials physics, 2005-03, Vol.71 (11), p.115332.1-115332.7, Article 115332

2005

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Titanium α − ω phase transformation pathway and a predicted metastable structure

Physical review. B, 2016-01, Vol.93 (2), Article 020104

2016

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First-principles prediction of phase-segregating alloy phase diagrams and a rapid design estimate of their transition temperatures

Physical review. B, Condensed matter and materials physics, 2007-03, Vol.75 (10), Article 104203

2007

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Controlling magnetostructural transition and magnetocaloric effect in multi-component transition-metal-based materials

Journal of applied physics, 2021-05, Vol.129 (19)

2021

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Magneto-structural transformations via a solid-state nudged elastic band method: Application to iron under pressure

The Journal of chemical physics, 2015-08, Vol.143 (6)

2015

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Titanium [alpha]-[omega] phase transformation pathway and a predicted metastable structure

Physical review. B, 2016-01, Vol.93 (2)

2016

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Reliable first-principles alloy thermodynamics via truncated cluster expansions

Physical review letters, 2004-06, Vol.92 (25), p.255702.1-255702.4, Article 255702

2004

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First-order magnetic phase transition in Pr2In with negligible thermomagnetic hysteresis

Physical review. B, 2020-06, Vol.101 (22), p.1

2020

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First-order magnetic phase transition in P r 2In with negligible thermomagnetic hysteresis

Physical review. B, 2020-06, Vol.101 (22)

2020

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First-order magnetic phase transition in P r 2 In with negligible thermomagnetic hysteresis

Physical review. B, 2020-06, Vol.101 (22), Article 224402

2020

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Predicting Enthalpies of Molecular Substances: Application to LiBH 4

Physical review letters, 2008-01, Vol.100 (4), Article 040602

2008

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Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

Journal of applied physics, 2014-05, Vol.115 (17)

2014

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Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

Journal of applied physics, 2014-05, Vol.115 (17)

2014

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Anomalous magneto-structural behavior of MnBi explained: A path towards an improved permanent magnet

APL materials, 2014-03, Vol.2 (3)

2014

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Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

Journal of applied physics, 2014-05, Vol.115 (17)

2014

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High-throughput search for caloric materials: the CaloriCool approach

Shape-memory transformations of NiTi: minimum-energy pathways between austenite, martensites, and kinetically limited intermediate states

Magneto-structural transformations via a solid-state nudged elastic band method: Application to iron under pressure

Thermal stability of MnBi magnetic materials

Coexistence pressure for a martensitic transformation from theory and experiment: Revisiting the bcc-hcp transition of iron under pressure

Controlling magnetostructural transition and magnetocaloric effect in multi-component transition-metal-based materials

Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

Predicting enthalpies of molecular substances: application to LiBH4

Structure and stability of hcp bulk and nano-precipitated Ag2Al

Energy scaling and surface patterning of halogen-terminated Si(0 0 1) surfaces

Crossover energetics for halogenated Si(100) : Vacancy line defects, dimer vacancy lines, and atom vacancy lines

Titanium α − ω phase transformation pathway and a predicted metastable structure

First-principles prediction of phase-segregating alloy phase diagrams and a rapid design estimate of their transition temperatures

Controlling magnetostructural transition and magnetocaloric effect in multi-component transition-metal-based materials

Magneto-structural transformations via a solid-state nudged elastic band method: Application to iron under pressure

Titanium [alpha]-[omega] phase transformation pathway and a predicted metastable structure

Reliable first-principles alloy thermodynamics via truncated cluster expansions

First-order magnetic phase transition in Pr2In with negligible thermomagnetic hysteresis

First-order magnetic phase transition in P r 2In with negligible thermomagnetic hysteresis

First-order magnetic phase transition in P r 2 In with negligible thermomagnetic hysteresis

Predicting Enthalpies of Molecular Substances: Application to LiBH 4

Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

Anomalous magneto-structural behavior of MnBi explained: A path towards an improved permanent magnet

Development of MnBi permanent magnet: Neutron diffraction of MnBi powder

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