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APDIC report 2018
French contribution
Jean-Marc Joubert
22nd May 2019
1. Presentation of the group
GdR TherMatHT (https://www.thermatht.fr/ ) is the formal French representative and member of
the APDIC. It is a Research Network (Groupement de Recherche) labelled by the CNRS existing since
January 2013. It is headed by Olivier Dezellus and gathers all the French activities on the
thermodynamic of the materials at high temperature, including a significant contribution to the
phase diagrams of alloys and ceramics.
2. Group activities in 2018
2018 was marked by the launch of an internal call dedicated to finance internal research projects
involving, in particular, younger researchers (internship, PhD students, post-docs). After the success
of the first year, the call was reopen in 2019.
A bibliographic library was opened to gather all the publications made by the group. It can be
alimented and viewed at https://hal.archives-ouvertes.fr/GDR_THERMATHT/
A facility was created representing a skill inventory of the different members of the GdR. It can be
found at https://www.thermatht.fr/bdd-liste-enregistrements/. A search can be made according to
different criteria like skills, or systems of interest.
The Annual meeting of the GdR TherMatHT was held in Marcoule January 26-27, 2018.
https://thermatht4.sciencesconf.org/
The GdR TherMatHT has made a formal subscription as a foreign participant to the Thermodynamic
Consortium (ThermoCon) of Alexandra Navrotsky. Christophe Drouet (Cirimat, Toulouse) represents
the GdR to the ThermoCon meetings. https://www.thermocon.org/
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3. Main events related to Phase Diagrams in France in 2018
3.1 Conference Matériaux 2018
The largest French conference on materials, held every 4 years, has been organized in Strasbourg,
November 19-23, 2018. It gathered more than 800 people.
http://www.materiaux2018.fr/
2.2. Conference Thermec
The International Conference on PROCESSING & MANUFACTURING OF ADVANCED MATERIALS,
Processing, Fabrication, Properties, Applications (Thermec) was held in Paris, July 8-13, 2018
https://thermec2018.sciencesconf.org/
2.3. Thermo-Calc user group meeting
Thermo-Calc has organized its French Computational and Kinetics Seminar also known as Thermo-
Calc user's meeting in Nice (Sophia Antipolis) on October 30, 2018.
3. Upcoming events in 2019
3.1. Conference La Métallurgie Quel Avenir ! (Metallurgy, what a future !)
A conference on Metallurgy will be held in Nancy, 8-12 April 2019. https://sf2m.fr/events/la-
metallurgie-quel-avenir/
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4. List of the teams and members of the GdR TherMatHT
Contact persons in bold
Laboratoire Nom Prénom email Website Systems of interest
Calcul Thermodynamique – Orcet Dupin Nathalie
[email protected] http://cthermo.fr/
CEA Cadarache DEN/DEC/SA3C/LAMIR Pointillon Yves
Fiquet Olivier
Carlot Gaelle
Dumas Jean-Christophe
Martin Philippe
Martin Guillaume
Palancher Hervé
CEA Cadarache DEN/DEC/SPUA/LMPC Belin Renaud
Lechelle Jacques
CEA Cadarache DEN/DEC/SPUA/LTEC Audubert Fabienne
CEA Cadarache DEN/DTN/STRI/LMA Journeau Christophe
Piluso Pascal
CEA Marcoule DEN/DTCD/SECM/LDMC Regnier Elise
CEA Marcoule DEN/DTEC/SDTC/LEMA Delahaye Thibaud
CEA Saclay DEN/DMN/SRMA/LA2M
Toffolon-Masclet Caroline
[email protected] https://www.universite-paris-saclay.fr/fr/recherche/laboratoire/service-de-recherches-metallurgiques-appliquees-srma-0
Roubaud J.
Guilbert T.
CEA Saclay DEN/DMN/SRMA/LTME Braun James
CEA Saclay DEN/DPC/SCCME/LM2T Alpettaz Thierry
Bordier Sébastien
Chatain Sylvie
Gossé Stéphane [email protected]
Guéneau Christine
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Lizon a Lugrin Eric
Quaini Andrea
CEA Saclay DEN/DPC/SCCME/LM2C Freyss Michel
UO2, PuO2, UPuO2, AmO2, UPuAmO2, CeO2, UCeO2
CEA Saclay DSM/IRAMIS/SI2SM/LEEL Berger Pascal
Khodja Hicham
Raepsaet Caroline
CEA DTBH Defoort Françoise
Froment Karine
Ravel Serge
Seiler Jean-Marie
CEA Marcoule DEN/DTCD/SECM/LCLT Nicoleau Elodie
CEA Marcoule DEN/DTCD/SECM/LDMC Boué Elodie
Cozzika Théodore
Hugon Isabelle
Laplace Annabelle
Pinet Olivier
Schuller Sophie [email protected]
CEA Valduc Oudot Benoît [email protected] http://www.cea.fr/pages/le-cea/les-centres-
cea/valduc.aspx actinides
CEMHTI – Orléans Bouchetou Marie-Laure
de Bilbao Emmanuel [email protected]
http://www.cemhti.cnrs-orleans.fr/
Poirier Jacques
CIRIMAT – Toulouse Blanc Christine
Connetable Damien
Drouet Christophe [email protected] http://www.cirimat.cnrs.fr/
Lacaze Jacques
Rouaix Vande Put Aurélie
Vahlas Constantin
Barnabé Antoine Cu-Fe-O, Cu-Cr-O
CMTC – Grenoble Fischer Evelyne [email protected]
http://cmtc.grenoble-inp.fr/
ICAMS – Bochum (Germany) Fries Suzana [email protected]
http://www.icams.de/content/
Palumbo Mauro
ICB – Dijon Barras Florence
Bernard Frédéric
Dereux Alain [email protected] https://scanr.enseignementsup-
recherche.gouv.fr/structure/201220440V
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Le Gallet Sophie
ICG – Montpellier Berche Alexandre
Tedenac Jean-Claude
Jund Philippe
[email protected] https://www.umontpellier.fr/recherche/unites-de-recherche/institut-charles-gerhardt-montpellier-icgm
ICMCB – Bordeaux Gorsse Stéphane [email protected] http://www.icmcb-bordeaux.cnrs.fr/ HEA, CCA, RHEA, RCCA
IEMN – Lille Hourlier Jamila https://www.iemn.fr/cellule-technologique-
renatech
Wallart Xavier
IJL – Nancy Aeby-Gautier Elisabeth
Aranda Lionel
Berthod Patrice
Combeau Hervé
Daloz Dominique
David Nicolas
Dehmas Moukrane
Denis Sabine
Fiorani Jean-Marc [email protected]
https://ijl.univ-lorraine.fr/a-la-une/
Geandier Guillaume
Mathieu Stéphane
Redjaimia Abdelkrim
Teixeira Julien
Vilasi Michel [email protected]
Zaloznik Miha
Zollinger Julien [email protected]
IM2NP – Marseille Benigni Pierre [email protected] https://www.im2np.fr/fr/accueil Ag-Cd-In-Zr, Ag-Al, Al-Zr, Cr-Te, Na2O-SiO2, Al-
Mg-B-C, Cs-Mo-O
Coulet Marie-Vanessa
Favotto Claude
Hassam Sheherazade
Maugis Philippe Fe-C
Mikaelian Georges Ag-Cd-In-Zr, Cr-Te
Rogez Jacques
ICMPE – Thiais Crivello Jean-Claude
Joubert Jean-Marc
[email protected] http://www.icmpe.cnrs.fr/ Mo-Ni, Mo-Ni-Re, Os-Pt, H-Mg, Cr-H, H-Hf, H-Zr, H-Nb, H-Nb-Zr, Mo-Ru, Mo-Ru-Tc, Al-Fe-V, Al-W, Ti-W, Al-Ti-W, Co-Cr-Fe-Mn-Ni, Al-Co-Cr-Fe-Ni-Ti, Cr-Fe-Nb-Sn-Zr, H-O-Zr, Cr-Fe-H-Nb-O-Sn-Zr
IPGP – Paris Gaillardet Jérôme
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Neuville Daniel [email protected] http://www.ipgp.fr/fr
Richet Pascal
Roux Jacques
IRSN – Cadarache Barrachin Marc [email protected] https://www.irsn.fr/FR/Pages/Home.aspx
Michel B.
Piar B.
Lafarge LCR – St Quentin Fallavier
https://www.tenerrdis.fr/fr/annuaire/lafarge-centre-de-recherche/
LCTS – Bordeaux Jacques Sylvain
Lepetitcorps Yann
Rebillat Francis
Roger Jérôme
Teyssandier Francis [email protected]
LGC – Toulouse Cassayre Laurent [email protected] https://lgc.cnrs.fr/ Cu-Fe-O, Cr-Fe-O, Co-Fe-O, Mn-Fe-O, C-H-O-
N+inorganics
Chamelot Pierre
LMGP – Grenoble Chaussende Didier [email protected]
http://www.lmgp.grenoble-inp.fr/
LMI – Lyon Andrieux Jérôme
Auvray Laurent
Carole Davy
Cauwet François
Dezellus Olivier [email protected] http://lmi.cnrs.fr/ Al-Si-Fe, Al-Si-Ti, Al-C-Mg, C-Ti, C-Ti-Fe, Ag-Cu-
Ti, Al-C-Si-Ti
Ferro Gabriel
Gardiola Bruno
Samer Nassim
Soulière Véronique
LNE – Paris Joumani Youssef https://www.lne.fr/
LPSC – Grenoble Ghetta Véronique [email protected] http://lpsc.in2p3.fr/index.php/fr/
Centre des Matériaux – Corbeil-Essones Bienvenu Yves
[email protected] http://www.mat.mines-paristech.fr/Accueil/
ONERA – Chatillon Perrut Mikaël [email protected] https://www.onera.fr/fr
Gheno Thomas
PROMES – Odeillo-Font Romeu Abanades Stéphane
Balat-Pichelin Marianne [email protected] https://www.promes.cnrs.fr/
Charpentier Ludovic
SETARAM – Caluire-et-Cuire André Rémi [email protected] https://www.setaram.fr/
SIMaP – Grenoble Antoni Annie [email protected] http://simap.grenoble-inp.fr/ Al-Nb, Co-Fe-W, Fe-Mo-W, B-Fe-Ti, Mn-Al-C-Fe-
Mn, Al-Cu-X
Blanquet Elisabeth
Chatillon Christian
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Duffar Thierry
Hodaj Fiqiri
Jakse Noel
Nuta Ioana [email protected]
Pasturel Alain
Tassin Catherine
Etay Jacqueline
Pisch Alexander
CaO-K2O-SiO2, CaO-Al2O3-SiO2, CaO-Al2O3-TiOx
SPCTS – Limoges Maître Alexandre
Rapaud Olivier [email protected] https://www.ircer.fr/ B-C-Fe, B-C-Hf-O-Si, B-C-O-Si-Zr, High Entropy
Ceramics, MAX phases, MXenes
Rejasse Florian
Trolliard Gilles
SYMME – Annecy Antion Caroline
Janghorban Amin
Lomello-Tafin Marc [email protected] http://www.symme.univ-smb.fr/
Thermodata Cheynet Bertrand
UCCS – Lille Montagne Lionel [email protected] http://uccs.univ-lille1.fr/index.php/fr/
UMET – Lille Legris Alexandre [email protected] http://umet.univ-lille1.fr/
Reumont Guy
ISCR – Rennes Tougait Olivier https://iscr.univ-rennes1.fr/umr/
Friedrich Alexander Universität – Erlangen-Nürnberg (Germany) de Ligny Dominique
[email protected] https://www.fau.de/
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Maps indicating the localization of the different research centers in France and in Paris area:
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5. List of publications
Two lists of publications related to phase diagrams are given. They are meant to describe the activity
of France in the field of phase diagrams for the year 2018.
The first list has been obtained using Web of Science with the following key: Topic='phase diagram',
Address='France', Year='2018'. The initial result (~400 publications) was sorted and only the
publications which seem really related to phase diagram studies are given below (65 entries). Note
that the list is probably non-exhaustive and some of the listed papers are only slightly related to
phase diagrams studies in the meaning of the APDIC.
The second list is taken from the internal database of our GdR group. As it fed by the different
members of the group, it is probably neither exhaustive nor up-to-date (22 entries).
First list
Dirac parameters and topological phase diagram of Pb1-xSnxSe from magnetospectroscopy
By: Krizman, G.; Assaf, B. A.; Phuphachong, T.; et al.
PHYSICAL REVIEW B Volume: 98 Issue: 24 Article Number: 245202 Published: DEC 26 2018
Thermodynamic investigations of the uranium-molybdenum-oxygen system by a coupling of density functional theory and CALPHAD methodologies
By: Corcoran, E. C.; Fleche, J. -L.; Dupin, N.; et al.
CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY Volume: 63 Pages: 196-211 Published: DEC 2018
Modeling of eutectic growth kinetics with thermodynamic couplings
By: Senninger, Oriane; Gandin, Charles-Andre; Guillemot, Gildas
ACTA MATERIALIA Volume: 161 Pages: 110-126 Published: DEC 2018
Implementation of an Effective Bond Energy Formalism in the Multicomponent Calphad Approach
By: Dupin, Nathalie; Kattner, Ursula R.; Sundman, Bo; et al.
JOURNAL OF RESEARCH OF THE NATIONAL INSTITUTE OF STANDARDS AND TECHNOLOGY Volume: 123 Article Number: 020 Published: NOV 26 2018
Multiferroic phase diagram of E-type RMnO3 films studied by neutron and x-ray diffraction
By: Mukherjee, Saumya; Shimamoto, Kenta; Windsor, Yoav William; et al.
PHYSICAL REVIEW B Volume: 98 Issue: 17 Article Number: 174416 Published: NOV 13 2018
Chemical crystallographic investigation on Cu2S-In2S3-Ga2S3 ternary system
By: Thomere, A.; Guillot-Deudon, C.; Caldes, M. T.; et al.
Conference: European-Materials-Research-Society (EMRS) Spring Meeting / Sympsium A on Thin Film Chalcogenide Photovoltaic Materials (ChalcogenidePV)
Location: Strasbourg, FRANCE Date: JUN 18-22, 2018
Sponsor(s): European Mater Res Soc
THIN SOLID FILMS Volume: 665 Pages: 46-50 Published: NOV 1 2018
Laser-heating system for high-pressure X-ray diffraction at the Extreme Conditions beamline I15 at Diamond Light Source
By: Anzellini, Simone; Kleppe, Annette K.; Daisenberger, Dominik; et al.
JOURNAL OF SYNCHROTRON RADIATION Volume: 25 Pages: 1860-1868 Part: 6 Published: NOV 2018
Computational design of light and strong high entropy alloys (HEA): Obtainment of an extremely high specific solid solution hardening
By: Menou, Edern; Tancret, Franck; Toda-Caraballo, Isaac; et al.
SCRIPTA MATERIALIA Volume: 156 Pages: 120-123 Published: NOV 2018
Magnetic structure and field-dependent magnetic phase diagram of Ni2In-type PrCuSi
By: Nair, Harikrishnan S.; Kumar, C. M. N.; Adroja, D. T.; et al.
JOURNAL OF PHYSICS-CONDENSED MATTER Volume: 30 Issue: 43 Article Number: 435803 Published: OCT 31 2018
Thermodynamic assessment of the Fe-Te system. Part II: Thermodynamic modeling
By: Arvhult, C-M.; Gueneau, C.; Gosse, S.; et al.
JOURNAL OF ALLOYS AND COMPOUNDS Volume: 767 Pages: 883-893 Published: OCT 30 2018
Solving Controversies on the Iron Phase Diagram Under High Pressure
By: Morard, Guillaume; Boccato, Silvia; Rosa, Angelika D.; et al.
GEOPHYSICAL RESEARCH LETTERS Volume: 45 Issue: 20 Pages: 11074-11082 Published: OCT 28 2018
Thermodynamic assessment of Hafnium Iridium binary system
By: Idbenali, Mohamed; Servant, Colette; Feddaoui, M'barek
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METALLURGICAL RESEARCH & TECHNOLOGY Volume: 115 Issue: 5 Article Number: 503 Published: OCT 23 2018
A Review of Calphad Modeling of Ordered Phases
By: Sundman, Bo; Chen, Qing; Du, Yong
JOURNAL OF PHASE EQUILIBRIA AND DIFFUSION Volume: 39 Issue: 5 Special Issue: SI Pages: 678-693 Published: OCT 2018
Archaeological Arsenical Bronzes and Equilibrium in the As-Cu System
By: Modlinger, Marianne; Cziegler, Andreas; Maccio, Daniele; et al.
METALLURGICAL AND MATERIALS TRANSACTIONS B-PROCESS METALLURGY AND MATERIALS PROCESSING SCIENCE Volume: 49 Issue: 5 Pages: 2505-2513
Published: OCT 2018
Ferrite, martensite and supercritical iron: A coherent elastochemical theory of stress-induced carbon ordering in steel
By: Maugis, P.
ACTA MATERIALIA Volume: 158 Pages: 454-465 Published: OCT 1 2018
Laser heating investigation of the high-temperature interaction between zirconium and UO2
By: Quaini, A.; Gosse, S.; Gueneau, C.; et al.
JOURNAL OF NUCLEAR MATERIALS Volume: 509 Pages: 517-526 Published: OCT 2018
Local environment dependence of Mn magnetism in bcc iron-manganese alloys: A first-principles study
By: Schneider, Anton; Fu, Chu-Chun; Barreteau, Cyrille
PHYSICAL REVIEW B Volume: 98 Issue: 9 Article Number: 094426 Published: SEP 26 2018
The updated Zn-Sb phase diagram. How to make pure Zn13Sb10 ("Zn4Sb3").
By: Lo, Chun-Wan Timothy; Svitlyk, Volodymyr; Chernyshov, Dmitry; et al.
DALTON TRANSACTIONS Volume: 47 Issue: 33 Pages: 11512-11520 Published: SEP 7 2018
Hydrogen supersaturated layers in H/D plasma-loaded tungsten: A global model based on thermodynamics, kinetics and density functional theory data
By: Hodille, E. A.; Fernandez, N.; Piazza, Z. A.; et al.
PHYSICAL REVIEW MATERIALS Volume: 2 Issue: 9 Article Number: 093802 Published: SEP 7 2018
Direct Reaction of Nitrogen and Lithium up to 75 GPa: Synthesis of the Li3N, LiN, LiN2, and LiN5 Compounds
By: Laniel, Dominique; Weck, Gunnar; Loubeyre, Paul
INORGANIC CHEMISTRY Volume: 57 Issue: 17 Pages: 10685-10693 Published: SEP 3 2018
Structural, thermal and optical investigations of PbF2:Eu3+ particles prepared by co-precipitation method
By: Belhouni, A.; Gredin, P.; Mortier, M.; et al.
OPTICAL MATERIALS Volume: 83 Pages: 321-327 Published: SEP 2018
Thermodynamic modeling of the Mo-Ni system
By: Yaqoob, Khurram; Crivello, Jean-Claude; Joubert, Jean-Marc
CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY Volume: 62 Pages: 215-222 Published: SEP 2018
Contribution of cooking and drying to the structure of couscous grains made from durum wheat semolina
By: Bellocq, Bettina; Ruiz, Thierry; Cuq, Bernard
CEREAL CHEMISTRY Volume: 95 Issue: 5 Pages: 646-659 Published: SEP-OCT 2018
Magnetic and Structural Quantum Phase Transitions in CeCu6-xAux are Independent
By: Grube, K.; Pintschovius, L.; Weber, F.; et al.
PHYSICAL REVIEW LETTERS Volume: 121 Issue: 8 Article Number: 087203 Published: AUG 21 2018
Electrochemical impedance spectroscopy of iron corrosion in H2S solutions
By: Ayagou, Martien Duvall Deffo; Thi Tuyet Mai Tran; Tribollet, Bernard; et al.
ELECTROCHIMICA ACTA Volume: 282 Pages: 775-783 Published: AUG 20 2018
Exploration of the NaxMoO2 phase diagram for low sodium contents (x <= 0.5)
By: Vitoux, Laura; Guignard, Marie; Darriet, Jacques; et al.
JOURNAL OF MATERIALS CHEMISTRY A Volume: 6 Issue: 30 Pages: 14651-14662 Published: AUG 14 2018
Thermodynamic Reassessment of the Na-Cu and Na-K Binary Systems
By: Trofimov, Evgeny; Samoilova, Olga; Zaitseva, Olga; et al.
METALS Volume: 8 Issue: 8 Article Number: 629 Published: AUG 2018
Interaction of NiAl Intermetallic During SHS Synthesis with Ta Substrate
By: Shchukin, Alexander S.; Vrel, Dominique; Sytschev, Alexander E.
ADVANCED ENGINEERING MATERIALS Volume: 20 Issue: 8 Article Number: 1701077 Published: AUG 2018
Ni/GeSn solid-state reaction monitored by combined X-ray diffraction analyses: focus on the Ni-rich phase
By: Quintero, Andrea; Gergaud, Patrice; Aubin, Joris; et al.
JOURNAL OF APPLIED CRYSTALLOGRAPHY Volume: 51 Pages: 1133-1140 Part: 4 Published: AUG 2018
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On the Yttrium Tantalate - Zirconia phase diagram
By: Gurak, Mary; Flamant, Quentin; Laversenne, Laetitia; et al.
JOURNAL OF THE EUROPEAN CERAMIC SOCIETY Volume: 38 Issue: 9 Pages: 3317-3324 Published: AUG 2018
Irradiation-based design of mechanically resistant microstructures tuned via multiscale phase-field modeling
By: Demange, Gilles; Depinoy, Sylvain; Luneville, Laurence; et al.
SCIENTIFIC REPORTS Volume: 8 Article Number: 10237 Published: JUL 6 2018
On the use of CALPHAD-based enthalpy-temperature relations in suboxidized corium plane front solidification modelling
By: Tiwari, V.; Le Tellier, R.
ANNALS OF NUCLEAR ENERGY Volume: 117 Pages: 175-182 Published: JUL 2018
Effect of Cooling Rates on gamma -> alpha Transformation and Metastable States in Fe-Cu Alloys with Addition of Ni
By: Crozet, C.; Verdier, M.; Lay, S.; et al.
METALS AND MATERIALS INTERNATIONAL Volume: 24 Issue: 4 Pages: 681-692 Published: JUL 2018
The YbTe-SnTe-Bi2Te3 system
By: Aliev, Ziya S.; Amiraslanov, Imamaddin R.; Record, Marie-Christine; et al.
JOURNAL OF ALLOYS AND COMPOUNDS Volume: 750 Pages: 887-894 Published: JUN 25 2018
Ab initio description of the different phases in the Al-Fe-V system: Structure, magnetism and thermodynamics
By: Berche, Alexandre; Jund, Philippe
COMPUTATIONAL MATERIALS SCIENCE Volume: 149 Pages: 28-36 Published: JUN 15 2018
High-pressure phase diagram of hydrogen and deuterium sulfides from first principles: Structural and vibrational properties including quantum and
anharmonic effects
By: Bianco, Raffaello; Errea, Ion; Calandra, Matteo; et al.
PHYSICAL REVIEW B Volume: 97 Issue: 21 Article Number: 214101 Published: JUN 8 2018
Proton dynamics and the phase diagram of dense water ice
By: Hernandez, J. -A.; Caracas, R.
JOURNAL OF CHEMICAL PHYSICS Volume: 148 Issue: 21 Article Number: 214501 Published: JUN 7 2018
Simple-to-Complex Transformation in Liquid Rubidium
By: Gorelli, Federico A.; De Panfilis, Simone; Bryk, Taras; et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS Volume: 9 Issue: 11 Pages: 2909-2913 Published: JUN 7 2018
Phase diagram of the underdoped cuprates at high magnetic field
By: Chakraborty, Debmalya; Morice, Corentin; Pepin, Catherine
PHYSICAL REVIEW B Volume: 97 Issue: 21 Article Number: 214501 Published: JUN 4 2018
Solution properties and salt-solution equilibria in the H-Li-Na-K-Ca-Mg-Cl-H2O system at 25 degrees C: A new thermodynamic model based on Pitzer's
equations
By: Lassin, Arnault; Andre, Laurent; Lach, Adeline; et al.
CALPHAD-COMPUTER COUPLING OF PHASE DIAGRAMS AND THERMOCHEMISTRY Volume: 61 Pages: 126-139 Published: JUN 2018
Synthesis of bulk chromium hydrides under pressure of up to 120 GPa
By: Marizy, Adrien; Geneste, Gregory; Loubeyre, Paul; et al.
PHYSICAL REVIEW B Volume: 97 Issue: 18 Article Number: 184103 Published: MAY 18 2018
Experimental and thermodynamic assessment of the fluoride-rich region in the Cu-O-F system
By: Deschenes-Allard, Frederic; Robelin, Christian; Zanghi, Didier; et al.
THERMOCHIMICA ACTA Volume: 663 Pages: 194-214 Published: MAY 10 2018
Thermodynamics of phase-separating nanoalloys: Single particles and particle assemblies
By: Fevre, Mathieu; Le Bouar, Yann; Finel, Alphonse
PHYSICAL REVIEW B Volume: 97 Issue: 19 Article Number: 195404 Published: MAY 4 2018
Electronic, magnetic properties and phase diagrams of system with Fe4N compound: An ab initio calculations and Monte Carlo study
By: Masrour, R.; Jabar, A.; Hlil, E. K.
JOURNAL OF MAGNETISM AND MAGNETIC MATERIALS Volume: 453 Pages: 220-225 Published: MAY 1 2018
P-T Phase Diagram of LuFe2O4
By: Poienar, Maria; Bourgeois, Julie; Martin, Christine; et al.
CRYSTALS Volume: 8 Issue: 5 Article Number: 184 Published: MAY 2018
Pressure Dependence of the Liquidus and Solidus Temperatures in the Fe-P Binary System Determined by In Situ Ultrasonics: Implications to the Solidification
of Fe-P Liquids in Planetary Cores
By: Chantel, Julien; Jing, Zhicheng; Xu, Man; et al.
JOURNAL OF GEOPHYSICAL RESEARCH-PLANETS Volume: 123 Issue: 5 Pages: 1113-1124 Published: MAY 2018
12
Electric Field Effects During Solidification of the Ternary Oxide Eutectic Al2O3-YAG-ZrO2
By: Cherif, M.; Hicher, P.; Benamara, O.; et al.
CRYSTAL RESEARCH AND TECHNOLOGY Volume: 53 Issue: 5 Special Issue: SI Article Number: 1700251 Published: MAY 2018
A Theoretical Investigation of the Miscibility and Structural Properties of InxAlyGa1-x-yN Alloys
By: Mohamad, Ranim; Bere, Antoine; Hounkpati, Viwanou; et al.
PHYSICA STATUS SOLIDI B-BASIC SOLID STATE PHYSICS Volume: 255 Issue: 5 Article Number: UNSP 1700394 Published: MAY 2018
Melting experiments on Fe-Si-S alloys to core pressures: Silicon in the core?
By: Tateno, Shigehiko; Hirose, Kei; Sinmyo, Ryosuke; et al.
AMERICAN MINERALOGIST Volume: 103 Issue: 5 Pages: 742-748 Published: MAY 2018
Phase Diagram of the B-BN System at Pressures up to 24 GPa: Experimental Study and Thermodynamic Analysis
By: Solozhenko, Vladimir L.; Turkevich, Vladimir Z.
JOURNAL OF PHYSICAL CHEMISTRY C Volume: 122 Issue: 15 Pages: 8505-8509 Published: APR 19 2018
The phase diagrams of KCaF3 and NaMgF3 by ab initio simulations
By: Jakymiw, Clement; Vocadlo, Lidunka; Dobson, David P.; et al.
PHYSICS AND CHEMISTRY OF MINERALS Volume: 45 Issue: 4 Pages: 311-322 Published: APR 2018
Phase Equilibrium of Three Binary Mixtures Containing NO and Components Present in Ambient Air
By: Zhang, Fan; El Ahmar, Elise; Valtz, Alain; et al.
JOURNAL OF CHEMICAL AND ENGINEERING DATA Volume: 63 Issue: 4 Pages: 1021-1026 Published: APR 2018
Contribution to the thermodynamic description of the corium - The U-Zr-O system
By: Quaini, A.; Gueneau, C.; Gosse, S.; et al.
JOURNAL OF NUCLEAR MATERIALS Volume: 501 Pages: 104-131 Published: APR 1 2018
Stabilizing effect of alloying elements on metastable phases in cast aluminum alloys by CALPHAD calculations
By: Assadiki, Anass; Esin, Vladimir A.; Bruno, Miguel; et al.
COMPUTATIONAL MATERIALS SCIENCE Volume: 145 Pages: 1-7 Published: APR 1 2018
A corrosion mechanism of titanium diboride in KF - AlF3 - Al2O3 melt
By: Kontrik, Martin; Simko, Frantisek; Galuskova, Dagmar; et al.
JOURNAL OF THE EUROPEAN CERAMIC SOCIETY Volume: 38 Issue: 4 Pages: 1143-1151 Published: APR 2018
Thermodynamic assessment of the rhodium-ruthenium-oxygen (Rh-Ru-O) system
By: Gosse, S.; Bordier, S.; Gueneau, C.; et al.
JOURNAL OF NUCLEAR MATERIALS Volume: 500 Pages: 252-264 Published: MAR 2018
A stepwise thermodynamic modeling of the phase diagram for the Cu-Be system
By: Liu, Yuling; Sundman, Bo; Du, Yong; et al.
JOURNAL OF MATERIALS SCIENCE Volume: 53 Issue: 5 Pages: 3756-3766 Published: MAR 2018
Modelling the thermodynamics of air-component mixtures (N-2, O-2 and Ar): Comparison and performance analysis of available models
By: Lasala, Silvia; Privat, Romain; Jaubert, Jean-Noel; et al.
FLUID PHASE EQUILIBRIA Volume: 458 Pages: 278-287 Published: FEB 25 2018
Nitrogen-hydrogen-oxygen ternary phase diagram: New phases at high pressure from structural prediction
By: Shi, Jingming; Cui, Wenwen; Botti, Silvana; et al.
PHYSICAL REVIEW MATERIALS Volume: 2 Issue: 2 Article Number: 023604 Published: FEB 21 2018
Evidence of a one-dimensional thermodynamic phase diagram for simple glass-formers
By: Hansen, H. W.; Sanz, A.; Adrjanowicz, K.; et al.
NATURE COMMUNICATIONS Volume: 9 Article Number: 518 Published: FEB 6 2018
Study of the iron nitride FeN into the megabar regime
By: Laniel, Dominique; Dewaele, Agnes; Anzellini, Simone; et al.
JOURNAL OF ALLOYS AND COMPOUNDS Volume: 733 Pages: 53-58 Published: FEB 5 2018
Solubility in Zr-Nb alloys from first-principles
By: Cottura, Maeva; Clouet, Emmanuel
ACTA MATERIALIA Volume: 144 Pages: 21-30 Published: FEB 1 2018
Experimental investigation of the phase equilibria and thermodynamic assessment in the U-Ga and U-Al-Ga systems
By: Moussa, Chantal; Berche, Alexandre; Barbosa, Jose; et al.
JOURNAL OF NUCLEAR MATERIALS Volume: 499 Pages: 361-371 Published: FEB 2018
Interaction of tantalum, titanium and phosphorus at 1070 K: Phase diagram and structural chemistry
By: Lomnytska, Ya.; Dzevenko, M.; Babizhetskyy, V.; et al.
JOURNAL OF ALLOYS AND COMPOUNDS Volume: 732 Pages: 777-783 Published: JAN 25 2018
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Precipitation during the Nitriding in Fe-Cr-C Steels
By: Naima, Hamedi; Lamine, Djeghlal Med; Laurent, Barrallier
Conference: 9th International Conference on Advanced Nano Materials (ANM) Location: Aveiro, PORTUGAL Date: JUL 19-21, 2017
MATERIALS TODAY-PROCEEDINGS Volume: 5 Issue: 9 Pages: 17501-17514 Part: 2 Published: 2018
Second list
J. Andrieux, Bruno Gardiola, Olivier Dezellus. Synthesis of Ti matrix composites reinforced with TiC particles: in situ synchrotron X-ray diffraction and modeling
Journal of Materials Science, Springer Verlag, In press, ⟨10.1007/s10853-018-2258-8⟩
C. Crozet, M. Verdier, S. Lay, A. Antoni-Zdziobek. Effect of Cooling Rates on γ → α Transformation and Metastable States in Fe–Cu Alloys with Addition of Ni
Metals and Materials International, 2018, 24 (4), pp.681 - 692. ⟨10.1007/s12540-018-0080-0⟩
Alexandre Berche, P. Jund. Oxidation of half-Heusler NiTiSn materials: Implications for thermoelectric applications
Intermetallics, Elsevier, 2018, 92, pp.62 - 71. ⟨10.1016/j.intermet.2017.09.014⟩
Wei Liu, Xiao-Gang Lu, P. Boulet, M. -C. Record, Hao Wang et al. Influence of atomic mixing and atomic order on molar volume of the binary sigma phase
Intermetallics, Elsevier, 2018, 98, pp.95 - 105. ⟨10.1016/j.intermet.2018.04.008⟩
Wei Liu, Xiao-Gang Lu, P. Boulet, M. -C. Record. Influencing factors of atomic order in the binary sigma phase
Intermetallics, Elsevier, 2018, 93, pp.6 - 19. ⟨10.1016/j.intermet.2017.11.006⟩
Ziya Aliev, Imamaddin Amiraslanov, M. -C. Record, Jean-Claude Tedenac, Mahammad Babanly. The YbTe-SnTe-Bi 2 Te 3 system
Journal of Alloys and Compounds, Elsevier, 2018, ⟨10.1016/j.jallcom.2018.03.398⟩
A. Quaini, S. Gossé, E. Brackx, R. Domenger, M. Kurata et al. Thermodynamic investigations of the uranium-molybdenum-oxygen system by a coupling of
density functional theory and CALPHAD methodologies
Calphad, Elsevier, 2018, 63, pp.196-211. ⟨10.1016/j.calphad.2018.10.002⟩
Nathalie Dupin, Ursula Kattner, Bo Sundman, Mauro Palumbo, Bo Fries. Implementation of an Effective Bond Energy Formalism in the Multicomponent
Calphad Approach
Journal of Research of the National Institute of Standards and Technology, National Institute of Standards and Technology, 2018, 123, ⟨10.6028/jres.123.020⟩
[openaccess]
Nicolas Madern, Judith Monnier, Rita Baddour-Hadjean, Antonin Steckmeyer, Jean-Marc Joubert. Characterization of refractory steel oxidation at high
temperature
Corrosion Science, Elsevier, 2018, 132, pp.223 - 233. ⟨10.1016/j.corsci.2017.12.029⟩
Marwa Said, Laurent Cassayre, Jean-Louis Dirion, Ange Nzihou, Xavier Joulia. Influence of Nickel on Biomass Pyro-Gasification: Coupled Thermodynamic and
Experimental Investigations
Industrial and engineering chemistry research, American Chemical Society, 2018, ESCAPE-27 - European Symposium on Computer-Aided Process Engineering,
Barcelona, Spain, Oct. 1–5, 2017, 57 (30), p.9788-9797. ⟨https://pubs.acs.org/doi/abs/10.1021/acs.iecr.7b05201⟩. ⟨10.1021/acs.iecr.7b05201⟩
Stéphane Gorsse, Oleg N. Senkov. About the reliability of CALPHAD predictions in multicomponent systems
Entropy, MDPI, 2018, 20 (12), 899 (9 p.). ⟨https://www.mdpi.com/1099-4300/20/12/899⟩
Florian Rejasse, Olivier Rapaud, J. Léchelle, Gilles Trolliard, H. Khodja et al. Novel insight into the chemical analysis of light elements in oxycarbides
Acta Materialia, Elsevier, 2018, 157, pp.11-20. ⟨http://www.sciencedirect.com/science/article/pii/S1359645418305512⟩. ⟨10.1016/j.actamat.2018.07.023⟩
F. Réjasse, G. Trolliard, J. Léchelle, Olivier Rapaud, P. Carles et al. Study of the TiC{1-x} – TiO2 reactive interface
Acta Materialia, Elsevier, 2018, 146, pp.225-236. ⟨https://www.sciencedirect.com/science/article/pii/S1359645418300119⟩. ⟨10.1016/j.actamat.2017.12.055⟩
A. Quaini, C. Gueneau, S. Gosse, N. Dupin, E. Sundman et al. Contribution to the thermodynamic description of the corium - The U-Zr-O system
Journal of Nuclear Materials, 2018, 501, pp.104-131. ⟨10.1016/j.jnucmat.2018.01.023⟩
Stéphane Gorsse, Jean-Philippe Couzinié, Daniel Miracle. From high-entropy alloys to complex concentrated alloys
Comptes Rendus Physique, Elsevier Masson, 2018, 19 (8), pp.721-736
Bharat Gwalani, Stéphane Gorsse, Deep Choudhuri, Mark Styles, Yufeng Zheng et al. Modifying transformation pathways in high entropy alloys or complex
concentrated alloys via thermo-mechanical processing
Acta Materialia, Elsevier, 2018, 153, pp.169-185. ⟨10.1016/j.actamat.2018.05.009⟩
Khurram Yaqoob, Jean-Claude Crivello, Jean-Marc Joubert. Thermodynamic modeling of the Mo–Ni system
Calphad, Elsevier, 2018, 62, pp.215-222
Jean-Marc Joubert, Annie Antoni-Zdziobek, Jean-Claude Crivello. Summary report of CALPHAD XLVI - Saint-Malo, France, 2017
Calphad, Elsevier, 2018, 63, pp.229-290
14
Natacha Bourgeois, Jean-Claude Crivello, Pierre Cenedese, Valérie Paul-Boncour, Jean-Marc Joubert. Vibration analysis of hydrogen, deuterium and tritium in
metals: consequences on the isotope effect
Journal of Physics: Condensed Matter, IOP Publishing, 2018, 30 (33), pp.335402
Wei Liu, Xiao-Gang Lu, P. Boulet, M. -C. Record, Qing-Miao Hu. Influence of atomic order on the enthalpy of formation and bulk modulus of the sigma phase
Fluid Phase Equilibria, Elsevier, 2018, 459, pp.238 - 243. ⟨10.1016/j.fluid.2017.10.006⟩
Laurie André, Stéphane Abanades, Laurent Cassayre. Experimental and thermodynamic study of Co-Fe and Mn-Fe based mixed metal oxides for
thermochemical energy storage application
AIP Conference Proceedings, American Institute of Physics, 2018, SOLARPACES 2016: International Conference on Concentrating Solar Power and Chemical
Energy Systems, 1850 (1), pp.090002. ⟨10.1063/1.4984451⟩
R. Pothin, R.M. Ayral, Alexandre Berche, P. Ziolkowski, G. Oppitz et al. Computational and experimental analysis on Te-doped ZnSb thermoelectric material
Materials Research Bulletin, Elsevier, 2018, 101, pp.90 - 99. ⟨10.1016/j.materresbull.2017.12.025⟩
