346 citations · 1k across the 26 of their papers we have counts for
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Multivalley 3D Electronic Structure of PbSe from Soft-X-Ray ARPES and First-Principles Calculations
Zefeng Cai, Valentine V. Volobuev, Jędrzej Korczak +7
PbSe is a narrow-gap IV-VI semiconductor, whose multivalley valence bands, with maxima at the L, , and points, underpin its intermediate-temperature thermoelectric propertie…
Combining Quasiparticle Self-Consistent and Machine-Learned DFT+ to Assess Half-Metallicity in Co- and Ni-Based Heuslers
Zefeng Cai, Malcolm J. A. Jardine, Maituo Yu +6
Half-metallic Heusler compounds are of significant interest for spintronics. For device fabrication, compounds that can be epitaxially grown on III-V semiconductors are particularl…
Structure Prediction of Ionic Epitaxial Interfaces with Ogre Demonstrated for Colloidal Heterostructures of Lead Halide Perovskites
Stefano Toso, Derek Dardzinski, Liberato Manna +1
Colloidal epitaxial heterostructures are nanoparticles composed of two different materials connected at an interface, which can exhibit properties different from those of their ind…
Near-half-metallic state in the half Heusler PtMnSb film on a III-V substrate
Shinichi Nishihaya, Malcolm J. A. Jardine, Hadass S. Inbar +9
The interplay between half-metallic ferromagnetism and spin-orbit coupling within the inversion symmetry-broken structure of half Heuslers provides an ideal platform for various sp…
Structure Prediction of Epitaxial Organic Interfaces with Ogre, Demonstrated for TCNQ on TTF
Saeed Moayedpour, Imaneul Bier, Wen Wen +3
Highly ordered epitaxial interfaces between organic semiconductors are considered as a promising avenue for enhancing the performance of organic electronic devices including solar…
First Principles Assessment of CdTe as a Tunnel Barrier at the -Sn/InSb Interface
Malcolm J. A. Jardine, Derek Dardzinski, Maituo Yu +9
Majorana zero modes, with prospective applications in topological quantum computing, are expected to arise in superconductor/semiconductor interfaces, such as -Sn and InSb. Howe…