26 citations · 95 across the 9 of their papers we have counts for
9 papers
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…
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…
First Principles Study of the Electronic Structure of the NiMnIn/InAs and TiMnIn/InSb interfaces
Brett Heischmidt, Maituo Yu, Derek Dardzinski +5
We present a first-principles study of the electronic and magnetic properties of epitaxial interfaces between the Heusler compounds TiMnIn and NiMnIn and the III-V semicond…
Scale-dependent optimized homoepitaxy of InAs(111)A
Steffen Zelzer, Rajib Batabyal, Derek Dardzinski +3
We combined in-situ scanning tunneling microscopy (STM) with the conventional growth characterization methods of atomic force microscopy (AFM) and reflection high energy electron d…
Dependence of the electronic structure of the EuS/InAs interface on the bonding configuration
Maituo Yu, Saeed Moayedpour, Shuyang Yang +4
Recently, the EuS/InAs interface has attracted attention for the possibility of inducing magnetic exchange correlations in a strong spin-orbit semiconductor, which could be useful…
Structure Prediction of Epitaxial Inorganic Interfaces by Lattice and Surface Matching with Ogre
Saeed Moayedpour, Derek Dardzinski, Shuyang Yang +2
We present a new version of the Ogre open source Python package with the capability to perform structure prediction of epitaxial inorganic interfaces by lattice and surface matchin…
First principles feasibility assessment of a topological insulator at the InAs/GaSb interface
Shuyang Yang, Derek Dardzinski, Andrea Hwang +3
First principles simulations are conducted to shed light on the question of whether a two-dimensional topological insulator (2DTI) phase may be obtained at the interface between In…