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Naji, M. |
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Motta, Antonella |
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Aletan, Dirar |
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Mohamed, Tarek |
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Ertürk, Emre |
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Taccardi, Nicola |
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Kononenko, Denys |
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Petrov, R. H. | Madrid |
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Alshaaer, Mazen | Brussels |
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Bih, L. |
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Casati, R. |
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Muller, Hermance |
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Kočí, Jan | Prague |
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Šuljagić, Marija |
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Kalteremidou, Kalliopi-Artemi | Brussels |
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Azam, Siraj |
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Ospanova, Alyiya |
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Blanpain, Bart |
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Ali, M. A. |
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Popa, V. |
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Rančić, M. |
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Ollier, Nadège |
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Azevedo, Nuno Monteiro |
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Landes, Michael |
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Rignanese, Gian-Marco |
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Alling, Björn
in Cooperation with on an Cooperation-Score of 37%
Topics
Publications (50/50 displayed)
- 2024Suggesting the high-pressure route to metastable high entropy alloys with ultra-large lattice distortions
- 2023Effect of magnetic disorder on Cr interaction with 1/2 < 111 > screw dislocations in bcc ironcitations
- 2023First-principles demonstration of band filling-induced significant improvement in thermodynamic stability and mechanical properties of Sc1-xTaXB2 solid solutionscitations
- 2023First‐Principles Density Functional Theory and Machine Learning Technique for the Prediction of Water Adsorption Site on PtPd‐Based High‐Entropy‐Alloy Catalystscitations
- 2022Investigation of Ti-1_x(Zr,Ta,V,W)(x)B-2 and A(l3)Ti(1_x)(Zr,V)(x) grain refiners in additively manufactured Al-2 wt%Cu alloys by a high throughput methodcitations
- 2022The effect of strain and pressure on the electron-phonon coupling and superconductivity in MgB2-Benchmark of theoretical methodologies and outlook for nanostructure designcitations
- 2022p-type behavior of CrN thin films via control of point defectscitations
- 2022Tetragonal distortion in magnetron sputtered bcc-W films with supersaturated carboncitations
- 2022p -type behavior of CrN thin films via control of point defectscitations
- 2021Data-driven analysis of the rotational energy landscapes of an organic cation in a substituted alloy perovskite
- 2021Experimental and theoretical evidence of charge transfer in multi-component alloys - how chemical interactions reduce atomic size mismatchcitations
- 2021Local atomic configuration approach to the nonmonotonic concentration dependence of magnetic properties of Ni(2)Mn(1+x)Z(1-x) (Z = In, Sn, Sb) Heusler alloyscitations
- 2021Coupling of lattice dynamics and configurational disorder in metal deficient Al1-delta B2 from first-principlescitations
- 2021Phase Transformation and Superstructure Formation in (Ti0.5, Mg0.5)N Thin Films through High-Temperature Annealingcitations
- 2021Experimental and theoretical evidence of charge transfer in multi-component alloys : how chemical interactions reduce atomic size mismatchcitations
- 2020Interstitial carbon in bcc HfNbTiVZr high-entropy alloy from first principlescitations
- 2019Phase stability of three-dimensional bulk and two-dimensional monolayer As1-xSbx solid solutions from first principlescitations
- 2019Phase composition and transformations in magnetron-sputtered (Al,V)2O3 coatingscitations
- 2019Thermodynamic stability of hexagonal and rhombohedral boron nitride under chemical vapor deposition conditions from van der Waals corrected first principles calculationscitations
- 2018Stability of SnSe1-xSx solid solutions revealed by first-principles cluster expansioncitations
- 2018Lattice relaxations in disordered Fe-based materials in the paramagnetic state from first principlescitations
- 2018Theoretical study of phase stability, crystal and electronic structure of MeMgN2 (Me = Ti, Zr, Hf) compoundscitations
- 2018Resolving the debated atomic structure of the metastable cubic SiNx tissue phase in nanocomposites with TiNcitations
- 2017Nonequilibrium ab initio molecular dynamics determination of Ti monovacancy migration rates in B1 TiNcitations
- 2017Structural evolution in reactive RF magnetron sputtered (Cr,Zr)2O3 coatings during annealingcitations
- 2016Magnetically driven anisotropic structural changes in the atomic laminate Mn2GaCcitations
- 2016Transition-metal-nitride-based thin films as novel energy harvesting materialscitations
- 2016Theoretical and experimental study of metastable solid solutions and phase stability within the immiscible Ag-Mo binary systemcitations
- 2016Experimental and theoretical investigation of Cr 1-x Sc x N solid solutions for thermoelectricscitations
- 2016Structure and Bonding in Amorphous Cr1−xCx Nanocomposite Thin Films: X‐ray Absorption Spectra and First-Principles Calculationscitations
- 2016Experimental and theoretical investigation of Cr1-xScxN solid solutions for thermoelectricscitations
- 2015Dynamic and structural stability of cubic vanadium nitridecitations
- 2015Control of Ti1-xSixN nanostructure via tunable metal-ion momentum transfer during HIPIMS/DCMS co-depositioncitations
- 2014Nanostructuring and coherency strain in multicomponent hard coatingscitations
- 2014Metal to semiconductor transition and phase stability of Ti1-xMgxNy alloys investigated by first-principles calculationscitations
- 2014Effect of Al substitution on Ti, Al, and N adatom dynamics on TiN(001), (011), and (111) surfacescitations
- 2014First-principles calculations of the electronic, vibrational, and elastic properties of the magnetic laminate Mn2GaCcitations
- 2013Theoretical investigation of cubic B1-like and corundum (Cr1−xAlx)2O3 solid solutionscitations
- 2012First-principles study of the SiNx/TiN(001) interfacecitations
- 2012Configurational disorder effects on adatom mobilities on Ti1-xAlxN(001) surfaces from first principlescitations
- 2011Phase Stability and Elasticity of TiAlNcitations
- 2011Improving thermal stability of hard coating films via a concept of multicomponent alloyingcitations
- 2010Ab initio calculations and synthesis of the off-stoichiometric half-Heusler phase Ni1-xMn1+xSbcitations
- 2010Effects of volume mismatch and electronic structure on the decomposition of ScAlN and TiAlN solid solutionscitations
- 2010Phase stability of Ti2AlC upon oxygen incorporation: A first-principles investigationcitations
- 2010Theory of the ferromagnetism in Ti1-xCrxN solid solutionscitations
- 2009A theoretical study of disorder and decomposition in multinary nitrides hard coatings materials
- 2008Metastability of fcc-related Si-N phasescitations
- 2008Structure and thermal stability of arc evaporated (Ti0.33Al0.67)1 − xSixN thin filmscitations
- 2007Comparison of thermodynamic properties of cubic Cr 1-x Al x N and Ti 1-x Al x N from first-principles calculationscitations
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