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Physical Chemistry Chemical Physics : PCCP|December 10, 2015
Energetic stability, oxidation states, and electronic structure of Bi-doped NaTaO3: a first-principles hybrid functional studyPaul H Joo, Maziar Behtash, Kesong Yang
Scientific Reports|October 7, 2016
High-Throughput Design of Two-Dimensional Electron Gas Systems Based on Polar/Nonpolar Perovskite Oxide HeterostructuresKesong Yang, Safdar Nazir, Maziar Behtash, et al.
The Journal of Physical Chemistry. B|November 28, 2006
Theoretical study of N-doped TiO2 rutile crystalsKesong Yang, Ying Dai, Baibiao Huang, et al.
Physical Chemistry Chemical Physics : PCCP|February 16, 2016
Polarization effects on the interfacial conductivity in LaAlO3/SrTiO3 heterostructures: a first-principles studyMaziar Behtash, Safdar Nazir, Yaqin Wang, et al.
ACS Applied Materials & Interfaces|May 11, 2016
Creating Two-Dimensional Electron Gas in Polar/Polar Perovskite Oxide Heterostructures: First-Principles Characterization of LaAlO3/A(+)B(5+)O3Yaqin Wang, Wu Tang, Jianli Cheng, et al.
Physical Chemistry Chemical Physics : PCCP|November 16, 2016
High-mobility two-dimensional electron gas in SrGeO3- and BaSnO3-based perovskite oxide heterostructures: an ab initio studyYaqin Wang, Wu Tang, Jianli Cheng, et al.
ACS Applied Materials & Interfaces|June 12, 2015
Interface Energetics and Charge Carrier Density Amplification by Sn-Doping in LaAlO3/SrTiO3 HeterostructureSafdar Nazir, Jianli Cheng, Maziar Behtash, et al.
Physical Chemistry Chemical Physics : PCCP|November 13, 2015
Nb and Ta layer doping effects on the interfacial energetics and electronic properties of LaAlO3/SrTiO3 heterostructure: first-principles analysisSafdar Nazir, Maziar Behtash, Jianli Cheng, et al.
Nature Materials|May 15, 2012
A search model for topological insulators with high-throughput robustness descriptorsKesong Yang, Wahyu Setyawan, Shidong Wang, et al.
Physical Chemistry Chemical Physics : PCCP|June 29, 2018
First-principles studies of polar perovskite KTaO3 surfaces: structural reconstruction, charge compensation, and stability diagramYaqin Wang, Jianli Cheng, Maziar Behtash, et al.
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