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Tunable stacking fault energies by tailoring local chemical order in CrCoNi medium-entropy alloys

Proceedings of the National Academy of Sciences - PNAS, 2018-09, Vol.115 (36), p.8919-8924

2018

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Surface reconstruction and chemical evolution of stoichiometric layered cathode materials for lithium-ion batteries

Nature communications, 2014-03, Vol.5 (1), p.3529-3529, Article 3529

2014

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Magnetically driven short-range order can explain anomalous measurements in CrCoNi

Proceedings of the National Academy of Sciences - PNAS, 2021-03, Vol.118 (13)

2021

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Atomistic simulations of dislocation mobility in refractory high-entropy alloys and the effect of chemical short-range order

Nature communications, 2021-08, Vol.12 (1), p.4873-4873, Article 4873

2021

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Structural phase transformations in metallic grain boundaries

Nature communications, 2013, Vol.4 (1), p.1899-1899, Article 1899

2013

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Defect reconfiguration in a Ti-Al alloy via electroplasticity

Nature materials, 2021-04, Vol.20 (4), p.468-472

2021

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Matminer: An open source toolkit for materials data mining

Computational materials science, 2018-09, Vol.152 (C), p.60-69

2018

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High-throughput computational screening of thermal conductivity, Debye temperature, and Grüneisen parameter using a quasiharmonic Debye model

Physical review. B, Condensed matter and materials physics, 2014-11, Vol.90 (17), Article 174107

2014

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Melts of CrCoNi-based high-entropy alloys: Atomic diffusion and electronic/atomic structure from ab initio simulation

Applied physics letters, 2018-09, Vol.113 (11)

2018

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A Statistical Learning Framework for Materials Science: Application to Elastic Moduli of k-nary Inorganic Polycrystalline Compounds

Scientific reports, 2016-10, Vol.6 (1), p.34256-34256, Article 34256

2016

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Lead-free germanium iodide perovskite materials for photovoltaic applications

Journal of materials chemistry. A, Materials for energy and sustainability, 2015, Vol.3 (47), p.23829-23832

2015

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Probing the Stability and Band Gaps of Cs2AgInCl6 and Cs2AgSbCl6 Lead-Free Double Perovskite Nanocrystals

Chemistry of materials, 2019-05, Vol.31 (9), p.3134-3143

2019

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Universal structural parameter to quantitatively predict metallic glass properties

Nature communications, 2016-12, Vol.7 (1), p.13733-13733, Article 13733

2016

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Solution-Processed Tin-Based Perovskite for Near-Infrared Lasing

Advanced materials (Weinheim), 2016-10, Vol.28 (37), p.8191-8196

2016

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Morphology-Independent Stable White-Light Emission from Self-Assembled Two-Dimensional Perovskites Driven by Strong Exciton–Phonon Coupling to the Organic Framework

Chemistry of materials, 2017-05, Vol.29 (9), p.3947-3953

2017

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Evaluation of the constant potential method in simulating electric double-layer capacitors

The Journal of chemical physics, 2014-11, Vol.141 (18), p.184102-184102

2014

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Origin of dramatic oxygen solute strengthening effect in titanium

Science (American Association for the Advancement of Science), 2015-02, Vol.347 (6222), p.635-639

2015

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Dipolar cations confer defect tolerance in wide-bandgap metal halide perovskites

Nature communications, 2018-08, Vol.9 (1), p.3100-10, Article 3100

2018

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Anomalous size effect on yield strength enabled by compositional heterogeneity in high-entropy alloy nanoparticles

Nature communications, 2022-05, Vol.13 (1), p.2789-2789, Article 2789

2022

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A database to enable discovery and design of piezoelectric materials

Scientific data, 2015-09, Vol.2 (1), p.150053-150053, Article 150053

2015

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The chain of chirality transfer in tellurium nanocrystals

Science (American Association for the Advancement of Science), 2021-05, Vol.372 (6543), p.729-733

2021

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Second-Nearest-Neighbor Correlations from Connection of Atomic Packing Motifs in Metallic Glasses and Liquids

Scientific reports, 2015-11, Vol.5 (1), p.17429-17429, Article 17429

2015

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Elimination of oxygen sensitivity in α-titanium by substitutional alloying with Al

Nature communications, 2021-10, Vol.12 (1), p.6158-6158, Article 6158

2021

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Grand canonically optimized grain boundary phases in hexagonal close-packed titanium

Nature communications, 2024-08, Vol.15 (1), p.7049-10

2024

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Charting the complete elastic properties of inorganic crystalline compounds

Scientific data, 2015-03, Vol.2 (1), p.150009-150009, Article 150009

2015

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Tunable stacking fault energies by tailoring local chemical order in CrCoNi medium-entropy alloys

Surface reconstruction and chemical evolution of stoichiometric layered cathode materials for lithium-ion batteries

Magnetically driven short-range order can explain anomalous measurements in CrCoNi

Atomistic simulations of dislocation mobility in refractory high-entropy alloys and the effect of chemical short-range order

Structural phase transformations in metallic grain boundaries

Defect reconfiguration in a Ti-Al alloy via electroplasticity

Matminer: An open source toolkit for materials data mining

High-throughput computational screening of thermal conductivity, Debye temperature, and Grüneisen parameter using a quasiharmonic Debye model

Melts of CrCoNi-based high-entropy alloys: Atomic diffusion and electronic/atomic structure from ab initio simulation

A Statistical Learning Framework for Materials Science: Application to Elastic Moduli of k-nary Inorganic Polycrystalline Compounds

Lead-free germanium iodide perovskite materials for photovoltaic applications

Probing the Stability and Band Gaps of Cs2AgInCl6 and Cs2AgSbCl6 Lead-Free Double Perovskite Nanocrystals

Universal structural parameter to quantitatively predict metallic glass properties

Solution-Processed Tin-Based Perovskite for Near-Infrared Lasing

Morphology-Independent Stable White-Light Emission from Self-Assembled Two-Dimensional Perovskites Driven by Strong Exciton–Phonon Coupling to the Organic Framework

Evaluation of the constant potential method in simulating electric double-layer capacitors

Origin of dramatic oxygen solute strengthening effect in titanium

Dipolar cations confer defect tolerance in wide-bandgap metal halide perovskites

Anomalous size effect on yield strength enabled by compositional heterogeneity in high-entropy alloy nanoparticles

A database to enable discovery and design of piezoelectric materials

The chain of chirality transfer in tellurium nanocrystals

Second-Nearest-Neighbor Correlations from Connection of Atomic Packing Motifs in Metallic Glasses and Liquids

Elimination of oxygen sensitivity in α-titanium by substitutional alloying with Al

Grand canonically optimized grain boundary phases in hexagonal close-packed titanium

Charting the complete elastic properties of inorganic crystalline compounds

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