Thursday, March 16, 2017
11:15AM - 11:27AM
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S32.00001: Predicting giant caloric effects in selected magnetic and shape-memory alloys.
Nikolai Zarkevich, Durga Paudyal, Duane Johnson
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Thursday, March 16, 2017
11:27AM - 11:39AM
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S32.00002: Ab-Initio Insights into Novel Magnetic Behavior in the Mn$_{1-x}$Fe$_x$Ru$_2$Sn Pseudo-Binary Heusler
Elizabeth Decolvenaere, Michael Gordon, Ram Seshadri, Anton Van der Ven
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Thursday, March 16, 2017
11:39AM - 11:51AM
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S32.00003: First-principles prediction of a stable hexagonal phase of CH$_{\mathrm{3}}$NH$_{\mathrm{3}}$PbI$_{\mathrm{3}}$
Arashdeep Thind, Xing Huang, Rohan Mishra
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Thursday, March 16, 2017
11:51AM - 12:03PM
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S32.00004: Electronic and Magnetic Properties of Ba, Ni and BaNiO$_{3}$: A First-Principles Study
Rupesh Ghimire, Narayan Adhikari, Gopi Kaphle, Ramesh Mani
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Thursday, March 16, 2017
12:03PM - 12:15PM
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S32.00005: Controlling Elastic Properties in Perovskites with Polyhedral Connectivity
Nicholas Wagner, James Rondinelli
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Thursday, March 16, 2017
12:15PM - 12:51PM
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S32.00006: Making machine learning interatomic potentials accurate, efficient, and reliable
Invited Speaker:
Alexander Shapeev
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Thursday, March 16, 2017
12:51PM - 1:03PM
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S32.00007: Effective Hamiltonians to Describe Octahedral Tilt Instabilities in Halide Perovskites
Jonathon Bechtel, John Thomas, Anton Van der Ven
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Thursday, March 16, 2017
1:03PM - 1:15PM
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S32.00008: ABO3 perovskite topological insulators: the enabling electronic motif and its structural stability
Xiuwen Zhang, Leonardo Abdalla, Qihang Liu, Alex Zunger
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Thursday, March 16, 2017
1:15PM - 1:27PM
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S32.00009: First-principles predictions of perovskite-type alkali metal titanium oxyhydrides with two-dimensional electronic states
Nobuya Sato, Ryosuke Akashi, Shinji Tsuneyuki
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Thursday, March 16, 2017
1:27PM - 1:39PM
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S32.00010: First-principles Study of Phonons in Structural Phase Change of Ge-Sb-Te Compounds
Young-Sun Song, Jeongwoo Kim, Minjae Kim, Seung-Hoon Jhi
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Thursday, March 16, 2017
1:39PM - 1:51PM
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S32.00011: Tin sulfides and tin selenides at ambient and high pressure conditions
Kien Nguyen Cong, Joseph Gonzalez, Brad Steele, Ivan Oleynik
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Thursday, March 16, 2017
1:51PM - 2:03PM
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S32.00012: High-pressure intermetallic compounds and their properties in ambient-immiscible systems
Maximilian Amsler, Shahab Naghavi, Chris Wolverton
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Thursday, March 16, 2017
2:03PM - 2:15PM
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S32.00013: High-Throughput Design of Two-Dimensional Electron Gas Systems Based on Perovskite Oxide Heterostructures.
Kesong Yang, Safdar Nazir, Mazir Behtash, Jianli Cheng
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