Articles with "density hybrid" as a keyword



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Addendum to “Convergence of density and hybrid functional defect calculations for compound semiconductors”

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Published in 2017 at "Physical Review B"

DOI: 10.1103/physrevb.96.239903

Abstract: This paper reported first-principles supercell calculations for the formation enthalpy H of numerous charged defects in several semiconductors and insulators. The individual energy contributions leading to the final result for H , as given in… read more here.

Keywords: defect calculations; hybrid functional; functional defect; convergence density ... See more keywords
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Study on the Mechanical Behavior of a Dual-Density Hybrid Lattice Structure under Quasi-Static and Dynamic Compressions

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Published in 2023 at "Materials"

DOI: 10.3390/ma16103822

Abstract: The dual-phase lattice structure composed of the matrix phase (MP) and the reinforcement phase (RP) is a novel hybrid lattice showing excellent energy absorption ability. However, the mechanical behavior of the dual-phase lattice structure under… read more here.

Keywords: hybrid lattice; dual density; lattice structure; lattice ... See more keywords