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High spin polarization in the disordered quaternary Heusler alloy FeMnVGa
Shuvankar Gupta
,
Sudip Chakraborty
,
Vidha Bhasin
,
Santanu Pakhira
,
Shovan Dan
Article dans une revue
hal-04181900v1
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Data-Driven Score-Based Models for Generating Stable Structures with Adaptive Crystal Cells
Arsen Sultanov
,
Jean-Claude Crivello
,
Tabea Rebafka
,
Nataliya Sokolovska
Article dans une revue
hal-04469812v1
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Site occupancies in a chemically complex σ-phase from the high-entropy Cr–Mn–Fe–Co–Ni system
Jean-Marc Joubert
,
Yordan Kalchev
,
Andrea Fantin
,
Jean-Claude Crivello
,
Rico Zehl
Article dans une revue
hal-04246769v1
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Chemical Composition of Lithiated Nitrodonickelates Li 3– xy Ni x N: Evidence of the Intermediate Valence of Nickel Ions from Ion Beam Analysis and Ab Initio Calculations
Thomas Fernandes
,
Thomas Cavoué
,
Pascal Berger
,
Céline Barreteau
,
Jean-Claude Crivello
Article dans une revue
hal-04228615v1
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New approach to the compound energy formalism (NACEF) Part II. Thermodynamic modelling of the Al–Nb system supported by first-principles calculations
J.M. Fiorani
,
M. Badran
,
J.M. Joubert
,
J.C. Crivello
,
A.A.A.P. da Silva
Article dans une revue
hal-04246773v1
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Observation of charge transfer induced large enhancement of magnetic moment in a structurally disordered inverse Heusler alloy Fe 2 RuGe
Sudip Chakraborty
,
Shuvankar Gupta
,
Vidha Bhasin
,
Santanu Pakhira
,
Céline Barreteau
Article dans une revue
hal-04375113v1
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CoMnCrGa: a novel ferromagnetic material with high spin-polarization for room temperature spintronics
Shuvankar Gupta
,
Sudip Chakraborty
,
Vidha Bhasin
,
Santanu Pakhira
,
Shovan Dan
Article dans une revue
hal-04313220v1
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Investigations of the Mn–Ni–Sm ternary system by means of anomalous X-ray diffraction, X-ray absorption and DFT calculations
Nicolas Madern
,
Judith Monnier
,
Jean-Claude Crivello
,
Junxian Zhang
,
Karine Provost
Article dans une revue
hal-04252334v1
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Experimental determination of the H–Hf phase diagram using in situ neutron diffraction
Maxime Dottor
,
Jean-Claude Crivello
,
L. Laversenne
,
Jean-Marc Joubert
Article dans une revue
hal-04246782v1
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4 d element induced improvement of structural disorder and development of weakly reentrant spin-glass behavior in NiRuMnSn
Shuvankar Gupta
,
Sudip Chakraborty
,
Vidha Bhasin
,
Santanu Pakhira
,
Anis Biswas
Article dans une revue
hal-04182141v1
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SrCuP and SrCuSb Zintl phases as potential thermoelectric materials
A. Moll
,
A. Hamidou
,
J.-C. Crivello
,
J.-M. Joubert
,
E. Alleno
Article dans une revue
hal-03974626v1
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Honeycomb Constructs in the La–Ni Intermetallics: Controlling Dimensionality via p -Element Substitution
Vitalii Shtender
,
Volodymyr Smetana
,
Jean-Claude Crivello
,
Łukasz Gondek
,
Janusz Przewoźnik
Article dans une revue
hal-04294532v1
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Screening New Quaternary Semiconductor Heusler Compounds By Machine-Learning Methods
Runan Xie
,
Jean-Claude Crivello
,
Céline Barreteau
Article dans une revue
hal-04297452v1
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Critical reassessment of the H-Nb system and experimental investigation and thermodynamic modeling of the H-Nb-Zr system
Maxime Dottor
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-04246786v2
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Low temperature study of phase equilibria in the Co–Ni–W ternary system: Evidence of a new intermetallic phase Co3W-D0a
Nicolas Bouliez
,
Jérôme Andrieux
,
Rodica Chiriac
,
François Toche
,
Jean-Claude Crivello
Article dans une revue
hal-03371636v1
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Coexisting structural disorder and robust spin-polarization in half-metallic FeMnVAl
Shuvankar Gupta
,
Sudip Chakraborty
,
Santanu Pakhira
,
Celine Barreteau
,
Jean-Claude Crivello
Article dans une revue
hal-03812754v1
|
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Thermodynamic modeling of Cr and Cr–H systems up to high temperatures and high pressures
Maxime Dottor
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-03747843v1
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Influence of self-substitution on the thermoelectric Fe2VAl Heusler alloy
A. Diack-Rasselio
,
O. Rouleau
,
L. Coulomb
,
L. Georgeton
,
M. Beaudhuin
Article dans une revue
hal-03752661v1
|
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What is the Enthalpy Contribution to the Stabilization of the Co–Cr–Fe–Mn–Ni Faced-centered Cubic Solid Solution?
Guillaume Bracq
,
Jean-Claude Crivello
,
Mathilde Laurent-Brocq
,
Jean-Marc Joubert
,
Ivan Guillot
Article dans une revue
hal-03384670v1
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Supervised deep learning prediction of the formation enthalpy of complex phases using a DFT database: the σ−phase as an example
Jean-Claude Crivello
,
Jean-Marc Joubert
,
Nataliya Sokolovska
Article dans une revue
hal-03443566v1
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Modification of Lu's (2005) high pressure model for improved high pressure/high temperature extrapolations. Part II: modeling of osmium-platinum system at high pressure/high temperature
Jean-Marc Joubert
,
Jean-Claude Crivello
,
Kirill V Yusenko
Article dans une revue
hal-03295413v1
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Experimental study, first-principles calculation and thermodynamic modelling of the Cr–Fe–Nb–Sn–Zr quinary system for application as cladding materials in nuclear reactors.
Paul Lafaye
,
Caroline Toffolon-Masclet
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-03145651v2
|
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Modification of Lu's (2005) high pressure model for improved high pressure/high temperature extrapolations. Part I: modeling of platinum at high pressure/high temperature
Jean-Marc Joubert
,
Jean-Claude Crivello
,
G. Deffrennes
Article dans une revue
hal-03295408v1
|
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Thermodynamic modelling of the Fe-Sn-Zr system based on new experiments and first- principles calculations
Paul Lafaye
,
Caroline Toffolon-Masclet
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-02570991v1
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TbMgNi 4- x Co x –(H,D) 2 System. I: Synthesis, Hydrogenation Properties, and Crystal and Electronic Structures
Vitalii V Shtender
,
Valérie Paul-Boncour
,
Roman Denys
,
Jean-Claude Crivello
,
Ihor Yu. Zavaliy
Article dans une revue
hal-02436455v1
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Optimization of Criteria for an Efficient Screening of New Thermoelectric Compounds: The TiNiSi Structure-Type as a Case-Study
Céline Barreteau
,
Jean-Claude Crivello
,
Jean-Marc Joubert
,
Eric Alleno
Article dans une revue
hal-03007720v1
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Relation between the weak itinerant magnetism in A2Ni7 compounds ( A = Y, La) and their stacked crystal structures
J-C Crivello
,
V. Paul-Boncour
Article dans une revue
hal-02436487v1
|
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On the structure and electronic properties of Fe2V0.8W0.2Al thin films
E. Alleno
,
A. Berche
,
J.-C. Crivello
,
A. Diack-Rasselio
,
P. Jund
Article dans une revue
hal-02955610v1
|
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Materials for hydrogen-based energy storage – past, recent progress and future
Michael Hirscher
,
Volodymyr Yartys
,
Marcello Baricco
,
Jose Bellosta von Colbe
,
Didier Blanchard
Article dans une revue
hal-02517149v1
|
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Correlations between stacked structures and weak itinerant magnetic properties of La2−xYxNi7 compounds
Valérie Paul-Boncour
,
Jean-Claude Crivello
,
Nicolas Madern
,
Junxian Zhang
,
L. V. B. Diop
Article dans une revue
hal-02919132v1
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Reduced phase space of heat-carrying acoustic phonons in single-crystalline InTe
Shantanu Misra
,
Céline Barreteau
,
Jean-Claude Crivello
,
Valentina Giordano
,
John-Paul Castellan
Article dans une revue
hal-03093472v1
|
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Mechanosynthesis and Reversible Hydrogen Storage of Mg2Ni and Mg2Cu Alloys
Tohru Nobuki
,
Yuki Okuzumi
,
Minoru Hatate
,
Jean-Claude Crivello
,
Fermin Cuevas
Article dans une revue
hal-02050004v1
|
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Experimental and Theoretical Investigations on the Influence of A on the Hydrogen Sorption Properties of A Ni y Compounds, A = {Y, Sm, Gd}
Jean-Claude Crivello
,
Nicolas Madern
,
Junxian Zhang
,
Judith Monnier
,
Michel Latroche
Article dans une revue
hal-02324804v1
|
|
Pd–H and Ni–H phase diagrams using cluster variation method and Monte Carlo simulation
Natacha Bourgeois
,
Pierre Cenedese
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-02324820v1
|
|
Synthesis of Ti-Ni alloy by mechanical alloying and their hydrogen solubility
Tohru Nobuki
,
Minoru Hatate
,
Fermin Cuevas
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-02312372v1
|
|
Magnesium based materials for hydrogen based energy storage: Past, present and future
V.A. Yartys
,
M.V. Lototskyy
,
E. Akiba
,
R. Albert
,
E. Antonov
Article dans une revue
hal-02090051v1
|
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TiVZrNb Multi-Principal-Element Alloy: Synthesis Optimization, Structural, and Hydrogen Sorption Properties
Jorge Montero
,
Claudia Livia Zlotea
,
Gustav Ek
,
Jean-Claude Crivello
,
Laetitia Laversenne
Article dans une revue
hal-02310747v1
|
|
Description of terminal substitutional solid solutions using the sublattice model
Jean-Marc Joubert
,
Jean-Claude Crivello
Article dans une revue
hal-02333929v1
|
|
Experimental investigations and thermodynamic modelling of the Cr–Nb–Sn–Zr system
Paul Lafaye
,
Caroline Toffolon-Masclet
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-04427982v1
|
|
Looking for new thermoelectric materials among TMX intermetallics using high-throughput calculations
Céline Barreteau
,
Jean-Claude Crivello
,
Jean-Marc Joubert
,
Eric Alleno
Article dans une revue
hal-03007688v1
|
|
Fast synthesis of TiNi by mechanical alloying and its hydrogenation properties
Tohru Nobuki
,
Jean-Claude Crivello
,
Fermin Cuevas
,
Jean-Marc Joubert
Article dans une revue
hal-02279918v1
|
|
Atomic interactions in C15 Laves phases
J.-C. Crivello
,
J.-M. Joubert
,
T. Mohri
Article dans une revue
hal-02011308v1
|
|
Y6Mg9Co2 and Y9Mg30Co2: Novel magnesium-rich compounds representing new structure types
V.V. Shtender
,
V.V. Pavlyuk
,
R.V. Denys
,
J.-C. Crivello
,
O.Ya. Zelinska
Article dans une revue
hal-02332297v1
|
|
Summary report of CALPHAD XLVI - Saint-Malo, France, 2017
Jean-Marc Joubert
,
Annie Antoni-Zdziobek
,
Jean-Claude Crivello
Calphad, 2018, 63, pp.229-290
Article dans une revue
hal-02011295v1
|
|
Thermodynamic modeling of the Mo–Ni system
Khurram Yaqoob
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Calphad, 2018, 62, pp.215-222
Article dans une revue
hal-02011287v1
|
|
Vibration analysis of hydrogen, deuterium and tritium in metals: consequences on the isotope effect
Natacha Bourgeois
,
Jean-Claude Crivello
,
Pierre Cenedese
,
Valérie Paul-Boncour
,
Jean-Marc Joubert
Article dans une revue
hal-02011296v1
|
|
Synthesis of TiFe Hydrogen Absorbing Alloys Prepared by Mechanical Alloying and SPS Treatment
Tohru Nobuki
,
Taro Moriya
,
Minoru Hatate
,
Jean-Claude Crivello
,
Fermin Cuevas
Metals, 2018, 8 (4), pp.264-275
Article dans une revue
hal-02055814v1
|
|
Systematic First-Principles Study of Binary Metal Hydrides
Natacha Bourgeois
,
Jean-Claude Crivello
,
Pierre Cenedese
,
Jean-Marc Joubert
Article dans une revue
hal-01783928v1
|
|
Thermodynamic modelling of the Cr-Nb-Sn system
Paul Lafaye
,
Caroline Toffolon-Masclet
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-01786097v1
|
|
Order-disorder transitions in the Fe 2 VAl Heusler alloy
S. Maier
,
S. Denis
,
S. Adam
,
J.-C. Crivello
,
J.-M. Joubert
Article dans une revue
hal-01786101v1
|
|
Electronic structure, low-temperature transport and thermodynamic properties of polymorphic β-As2Te3
Jean-Baptiste Vaney
,
Jean-Claude Crivello
,
Cédric Morin
,
Gaëlle Delaizir
,
Julie Carreaud
Article dans une revue
hal-01325342v1
|
|
Thermodynamic assessment of the PdRhRu system using calphad and first-principles methods
S. Gossé
,
N. Dupin
,
C. Guéneau
,
J.-C. Crivello
,
J.-M. Joubert
Article dans une revue
hal-01786099v1
|
|
Properties of ZrNi5 deuteride synthesized under high pressure studied by neutron diffraction and first principles calculations
V. Paul-Boncour
,
S.M. Filipek
,
J.-C. Crivello
,
F. Couturas
,
A. Morawski
Article dans une revue
hal-01792342v1
|
|
First principles calculations of (La,Mg) 2 Ni 7 hydrides
Jean-Claude Crivello
,
Michèle Gupta
,
Michel Latroche
Article dans une revue
hal-01792339v1
|
|
Experimental study and thermodynamic description of the erbium–hydrogen–zirconium ternary system
Aurore Mascaro
,
Caroline Toffolon-Masclet
,
Caroline Raepsaet
,
Jean-Claude Crivello
,
Jean-Marc Joubert
Article dans une revue
hal-01157260v1
|
|
Irregular Homogeneity Domains in Ternary Intermetallic Systems
Jean-Marc Joubert
,
Mohamed Andasmas
,
Jean-Claude Crivello
Article dans une revue
hal-01786105v1
|
|
Polymorphism in Thermoelectric As2Te3
Cédric Morin
,
Serena Corallini
,
Julie Carreaud
,
Jean-Baptiste Vaney
,
Gaëlle Delaizir
Article dans une revue
hal-01219302v1
|
|
ZenGen, a tool to generate ordered configurations for systematic first-principles calculations: The Cr–Mo–Ni–Re system as a case study
J.-C. Crivello
,
R. Souques
,
A. Breidi
,
N. Bourgeois
,
J.-M. Joubert
Article dans une revue
hal-01786104v1
|
|
Thermodynamic Modeling of the Ni–H System
Natacha Bourgeois
,
Jean-Claude Crivello
,
Arkapol Saengdeejing
,
Ying Chen
,
Pierre Cenedese
Article dans une revue
hal-01786103v1
|
|
Hydrogen sorption properties of Pd–Co nanoalloys embedded into mesoporous carbons
Claudia Livia Zlotea
,
Camélia Matei Ghimbeu
,
Yassine Oumellal
,
Jean-Claude Crivello
,
Cathie Vix-Guterl
Article dans une revue
hal-02465149v1
|
|
Structural and magnetic properties of PrCo3−xFex by neutron powder diffraction and electronic structure investigations
K. Younsi
,
R. Bez
,
J.-C. Crivello
,
V. Paul-Boncour
,
K. Zehani
Article dans une revue
hal-01792337v1
|
|
Structural and magnetic properties of PrCo 3 − x Fe x by neutron powder diffraction and electronic structure investigations
K. Younsi
,
R. Bez
,
J.-C. Crivello
,
V. Paul-Boncour
,
K. Zehani
Article dans une revue
hal-04231999v1
|
|
First-principles-based phase diagrams and thermodynamic properties of TCP phases in Re–X systems (X=Ta, V, W)
Mauro Palumbo
,
Suzana Fries
,
Thomas Hammerschmidt
,
Taichi Abe
,
Jean-Claude Crivello
Article dans une revue
hal-01786110v1
|
|
Experimental and computed phase diagrams of the Fe–Re system
A. Breidi
,
M Andasmas
,
J-C Crivello
,
N. Dupin
,
J-M Joubert
Article dans une revue
hal-01786106v1
|
|
Phase stability in the ternary Re–W–Zr system
Jean-Marc Joubert
,
Jean-Claude Crivello
,
Mohamed Andasmas
,
Pierre Joubert
Article dans une revue
hal-01786107v1
|
|
Study of the magnetic and electronic properties of nanocrystalline PrCo 3 by neutron powder diffraction and density functional theory
Khedidja Younsi
,
Jean-Claude Crivello
,
Valérie Paul-Boncour
,
Lotfi Bessais
,
Florence Porcher
Article dans une revue
hal-04235316v1
|
|
χ and σ Phases in Binary Rhenium–Transition Metal Systems: a Systematic First-Principles Investigation
Jean-Claude Crivello
,
Abedalhasan Breidi
,
Jean-Marc Joubert
Article dans une revue
hal-01786961v1
|
|
Structural stability of ternary C22-Zr6X2Co (X=Al, Ga, Sn, As, Sb, Bi, Te) and C22-Zr6Sn2T′ (T′=Fe, Co, Ni, Cu) compounds
Colinet Catherine
,
Jean-Claude Crivello
,
Jean-Claude Tedenac
Article dans une revue
hal-00926750v1
|
|
CALPHAD description of the Mo-Re system focused on the sigma phase modeling
R. Mathieu
,
N. Dupin
,
J-C Crivello
,
K. Yaqoob
,
A. Breidi
Article dans une revue
hal-01289986v1
|
|
Structural and magnetic properties of nanocrystalline PrCo3−xFex
K. Younsi
,
Lotfi Bessais
,
J.-C. Crivello
,
V. Russier
Article dans une revue
hal-04235343v1
|
|
Hard Magnetic PrCo3 : Structural and Magnetic Properties
K. Younsi
,
Lotfi Bessais
,
V. Russier
,
J.C. Crivello
Proceeding of the TMS meeting, 2011, 1, pp.381-387
Article dans une revue
hal-04235173v1
|