Search Results - "Joubert, J. M."
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Crystal chemistry and Calphad modeling of the σ phase
Published in Progress in materials science (01-03-2008)“…A systematic review of the crystal chemical properties of the σ phase is presented, with special emphasis on the atomic order, i. e. the distribution of the…”
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Combining experiments and modeling to explore the solid solution strengthening of high and medium entropy alloys
Published in Acta materialia (15-09-2019)“…The mechanical properties due to solid solution strengthening are explored within the single phase face-centered cubic (fcc) domain of the Co–Cr–Fe–Mn–Ni high…”
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Magnesium based materials for hydrogen based energy storage: Past, present and future
Published in International journal of hydrogen energy (22-03-2019)“…Magnesium hydride owns the largest share of publications on solid materials for hydrogen storage. The “Magnesium group” of international experts contributing…”
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Order-disorder transitions in the Fe2VAl Heusler alloy
Published in Acta materialia (01-12-2016)“…A Rietveld analysis of neutron powder diffraction patterns obtained in situ during temperature scans shows that Fe2VAl crystallizes at room temperature in the…”
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SrCuP and SrCuSb Zintl phases as potential thermoelectric materials
Published in Journal of alloys and compounds (05-05-2023)“…We report the investigation of the thermoelectric properties of SrCuX (X = P or Sb), combining experiments and DFT calculations, for the first time for SrCuP…”
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The specific heat of Al-based compounds, evaluation of the Neumann-Kopp rule and proposal for a modified Neumann-Kopp rule
Published in Calphad (01-06-2023)“…Application of the Neumann-Kopp rule to aluminum containing compounds produces a kink in the specific heat caused by the description of pure aluminum in the…”
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β-1,3 Glucan Sulfate Induces Resistance in Grapevine against Plasmopara viticola Through Priming of Defense Responses, Including HR-like Cell Death
Published in Molecular plant-microbe interactions (01-02-2008)“…Sulfated laminarin (PS3) has been shown previously to be an elicitor of plant defense reactions in tobacco and Arabidopsis and to induce protection against…”
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Atomic interactions in C15 Laves phases
Published in Journal of materials science (01-03-2019)“…The C 15 phase ( F d 3 ¯ m ) has been extensively studied by several methodologies to evaluate its atomic interactions. Ideally ordered at the A B 2…”
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Crystal chemistry and Calphad modelling of the χ phase
Published in Progress in materials science (01-09-2009)“…This article is a comprehensive review devoted to the phase diagram and crystal structure properties of the χ phase intermetallic compound. An extensive study…”
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The T phase with the V6Si5 type structure in the Mo-Si-Ti system studied by ab initio calculations and X-ray diffraction
Published in Scripta materialia (15-01-2019)“…Previous experimental studies in the Mo-Si-Ti system have shown the existence of a ternary phase around the composition Mo4Si9Ti7. No crystal structure was…”
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Thermodynamic modeling of the Mo–Pt system based on the NACEF approach
Published in Calphad (01-03-2024)“…The present work reports on a thermodynamic modeling of the Mo–Pt system using a combined first-principles/CALPHAD approach. First-Principles (FP) calculations…”
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ZenGen, a tool to generate ordered configurations for systematic first-principles calculations: The Cr–Mo–Ni–Re system as a case study
Published in Calphad (01-12-2015)“…“ZenGen” is a script-tool which helps us to automatically generate first-principles input files of all the ordered compounds of a given crystal structure in a…”
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A Calphad-type equation of state for hydrogen gas and its application to the assessment of Rh–H system
Published in International journal of hydrogen energy (01-03-2010)“…A new equation of state for hydrogen gas (0 ≤ P ≤ 10 11 Pa, 298 ≤ T ≤ 1000 K) has been derived and is given in an analytical form. It is compatible with the…”
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Hydrogenation properties of Fe–Ti–V bcc alloys
Published in Journal of alloys and compounds (12-01-2011)“…▶ Hydrogen gas storage properties obtained from a fully determined Ti–V–Fe ternary phase diagram. ▶ Enthalpies of absorption and desorption linearly related to…”
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CALPHAD Modeling of Metal–Hydrogen Systems: A Review
Published in JOM (1989) (01-12-2012)“…A review of the metal–hydrogen systems modeled or investigated with the CALPHAD method is presented. The specific features of metal–hydrogen systems in…”
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In situ monitoring of isothermal phase transformation in two Nb stabilized austenitic stainless steels (316Nb) by neutron diffraction
Published in Journal of alloys and compounds (15-12-2016)“…In this study, neutron diffraction measurements have been performed to study the phase transformations taking place during isothermal treatments of two 316Nb…”
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Modification of the hydrogenation properties of LaNi5 upon Ni substitution by Rh, Ir, Pt or Au
Published in Journal of alloys and compounds (15-01-2012)Get full text
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Thermodynamic assessment of the Pd Rh Ru system using calphad and first-principles methods
Published in Journal of nuclear materials (01-06-2016)“…Palladium, rhodium and ruthenium are abundant fission products that form in oxide fuels in nuclear reactors. Under operating conditions, these Platinum-Group…”
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CALPHAD description of the Mo–Re system focused on the sigma phase modeling
Published in Calphad (01-12-2013)“…The phase equilibria and thermodynamic properties of the Mo–Re system are studied by combining first-principle and CALPHAD approach. The mixing enthalpies in…”
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The Zr–Sn binary system: New experimental results and thermodynamic assessment
Published in Calphad (01-09-2008)“…The Zr–Sn binary system has been reinvestigated by several experimental techniques: X-ray diffraction, electron probe micro-analysis, mass density and…”
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