Zeitschriftenartikel (574)
181.
        
            Zeitschriftenartikel
            
           Unveiling the mechanism of abnormal magnetic behavior of FeNiCoMnCu high-entropy alloys through a joint experimental - theoretical study. Physical Review Materials 4, 014402 (2020)
          182.
        
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           Frontiers in atomistic simulations of high entropy alloys. Journal of Applied Physics 128 (15), 150901 (2020)
          183.
        
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           Imaging individual solute atoms at crystalline imperfections in metals. New Journal of Physics 21 (12), 123020 (2019)
          184.
        
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           Phonon Lifetimes throughout the Brillouin Zone at Elevated Temperatures from Experiment and Ab Initio. Physical Review Letters 123 (23), 235501 (2019)
          185.
        
            Zeitschriftenartikel
            
           Role of hole confinement in the recombination properties of InGaN quantum structures. Scientific Reports 9 (1), 9047 (2019)
          186.
        
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           Al5+αSi5+δN12, a new Nitride compound. Scientific Reports 9 (1), 15907 (2019)
          187.
        
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           Ab initio vibrational free energies including anharmonicity for multicomponent alloys. npj Computational Materials 5 (1), 80 (2019)
          188.
        
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           Impact of lattice relaxations on phase transitions in a high-entropy alloy studied by machine-learning potentials. npj Computational Materials 5 (1), 55 (2019)
          189.
        
            Zeitschriftenartikel
            
           Impact of interstitial C on phase stability and stacking-fault energy of the CrMnFeCoNi high-entropy alloy. Physical Review Materials 3 (11), 113603 (2019)
          190.
        
            Zeitschriftenartikel
            
           Ab initio based method to study structural phase transitions in dynamically unstable crystals, with new insights on the β to ω transformation in titanium. Physical Review B 100 (10), 104110 (2019)
          191.
        
            Zeitschriftenartikel
            
           Ab initio phase stabilities of Ce-based hard magnetic materials and comparison with experimental phase diagrams. Physical Review Materials 3, 084407  (2019)
          192.
        
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           Invar effects in FeNiCo medium entropy alloys: From an Invar treasure map to alloy design. Intermetallics 111, 106520 (2019)
          193.
        
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           Fast anharmonic free energy method with an application to vacancies in ZrC. Physical Review B 100 (2), 024303 (2019)
          194.
        
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           The role of atomistic simulations in probing hydrogen effects on plasticity and embrittlement in metals. Engineering Fracture Mechanics 216, 106502 (2019)
          195.
        
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           Elasticity of phases in Fe–Al–Ti superalloys: Impact of atomic order and anti-phase boundaries. Crystals 9 (6), 299 (2019)
          196.
        
            Zeitschriftenartikel
            
           An insight into using DFT data for Calphad modeling of solid phases in the third generation of Calphad databases, a case study for Al. Calphad 65, S. 79 - 85 (2019)
          197.
        
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           Basal slip in laves phases: The synchroshear dislocation. Scripta Materialia 166, S. 134 - 138 (2019)
          198.
        
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           pyiron: An integrated development environment for computational materials sciences. Computational Materials Science 163, S. 24 - 36 (2019)
          199.
        
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           Quantification of solute deuterium in titanium deuteride by atom probe tomography with both laser pulsing and high-voltage pulsing: influence of the surface electric field. New Journal of Physics 21, 053025 (2019)
          200.
        
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           Phase stabilities and vibrational analysis of hydrogenated diamondized bilayer graphenes: A first principles investigation. Carbon 146, S. 468 - 475 (2019)