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Understanding how molecular arrangements within crystals influence their thermal behavior is a fundamental question in ...
In this study, thermo-elastic and lattice dynamic properties of XMgAl (X = Li, Na) half-Heusler compounds are investigated using density functional theory implemented in WIEN2k and Quantum ESPRESSO ...
Half of these compounds display heterogeneous nucleation, despite poor lattice matching based on unit cell dimensions . The nucleation efficiency and Avrami kinetics of these compounds were ...
At the core of this cluster is In 10 S 13, which can be considered as a fragment of the NaCl-type lattice. The In 10 S 13 cluster is coupled to four In 4 S 10 supertetrahedral T2 clusters and four In ...
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