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Single-Layer Group-III Monochalcogenide Photocatalysts for Water Splitting

Chemistry of materials, 2013-08, Vol.25 (15), p.3232-3238

2013

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Computational Search for Single-Layer Transition-Metal Dichalcogenide Photocatalysts

Journal of physical chemistry. C, 2013-10, Vol.117 (40), p.20440-20445

2013

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Electrochemical surface passivation of LiCoO2 particles at ultrahigh voltage and its applications in lithium-based batteries

Nature communications, 2018-11, Vol.9 (1), p.1-11, Article 4918

2018

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Ab Initio Prediction of Piezoelectricity in Two-Dimensional Materials

ACS nano, 2015-10, Vol.9 (10), p.9885-9891

2015

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Computational Screening of 2D Materials for Photocatalysis

The journal of physical chemistry letters, 2015-03, Vol.6 (6), p.1087-1098

2015

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Computational discovery of single-layer III-V materials

Physical review. B, Condensed matter and materials physics, 2013-04, Vol.87 (16), Article 165415

2013

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Prediction and Characterization of MXene Nanosheet Anodes for Non-Lithium-Ion Batteries

ACS nano, 2014-09, Vol.8 (9), p.9606-9615

2014

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Regulating Li deposition at artificial solid electrolyte interphases

Journal of materials chemistry. A, Materials for energy and sustainability, 2017, Vol.5 (7), p.3483-3492

2017

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Accuracy of exchange-correlation functionals and effect of solvation on the surface energy of copper

Physical review. B, Condensed matter and materials physics, 2013-06, Vol.87 (24), Article 245402

2013

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Ultrathin nanosheets of CrSiTe3: a semiconducting two-dimensional ferromagnetic material

Journal of materials chemistry. C, Materials for optical and electronic devices, 2016-01, Vol.4 (2), p.315-322

2016

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Computational prediction and characterization of single-layer CrS2

Applied physics letters, 2014-01, Vol.104 (2)

2014

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Softened Elastic Response and Unzipping in Chemical Vapor Deposition Graphene Membranes

Nano letters, 2011-06, Vol.11 (6), p.2259-2263

2011

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Semiconducting SiGeSn high-entropy alloy: A density functional theory study

Journal of applied physics, 2019-12, Vol.126 (22)

2019

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Machine-learning phase prediction of high-entropy alloys

Acta materialia, 2019-05, Vol.169, p.225-236

2019

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Stable Lithium Electrodeposition at Ultra‐High Current Densities Enabled by 3D PMF/Li Composite Anode

Advanced energy materials, 2018-05, Vol.8 (15), p.n/a

2018

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Machine learning for phase selection in multi-principal element alloys

Computational materials science, 2018-07, Vol.150, p.230-235

2018

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A "cation-anion regulation" synergistic anode host for dendrite-free lithium metal batteries

Science advances, 2018-02, Vol.4 (2), p.eaar4410-eaar4410

2018

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Enabling Stable Lithium Metal Anode via 3D Inorganic Skeleton with Superlithiophilic Interphase

Advanced energy materials, 2018-11, Vol.8 (33), p.n/a

2018

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Spin qubit based on the nitrogen-vacancy center analog in a diamond-like compound C3BN

Journal of applied physics, 2021-12, Vol.130 (22)

2021

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Enhanced Li–S Batteries Using Amine-Functionalized Carbon Nanotubes in the Cathode

ACS nano, 2016-01, Vol.10 (1), p.1050-1059

2016

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A Density Functional + U Assessment of Oxygen Evolution Reaction Mechanisms on β‑NiOOH

ACS catalysis, 2017-08, Vol.7 (8), p.5329-5339

2017

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Electronic structures of single-layer boron pnictides

Applied physics letters, 2012-10, Vol.101 (15)

2012

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Ab initio synthesis of single-layer III-V materials

Physical review. B, Condensed matter and materials physics, 2014-06, Vol.89 (24), Article 245431

2014

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Toward obtaining 2D and 3D and 1D PtPN with pentagonal pattern

Journal of materials science, 2019-11, Vol.54 (22), p.14029-14037

2019

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Layered tetragonal zinc chalcogenides for energy-related applications: from photocatalysts for water splitting to cathode materials for Li-ion batteries

Nanoscale, 2017-11, Vol.9 (44), p.1733-17311

2017

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Single-Layer Group-III Monochalcogenide Photocatalysts for Water Splitting

Computational Search for Single-Layer Transition-Metal Dichalcogenide Photocatalysts

Electrochemical surface passivation of LiCoO2 particles at ultrahigh voltage and its applications in lithium-based batteries

Ab Initio Prediction of Piezoelectricity in Two-Dimensional Materials

Computational Screening of 2D Materials for Photocatalysis

Computational discovery of single-layer III-V materials

Prediction and Characterization of MXene Nanosheet Anodes for Non-Lithium-Ion Batteries

Regulating Li deposition at artificial solid electrolyte interphases

Accuracy of exchange-correlation functionals and effect of solvation on the surface energy of copper

Ultrathin nanosheets of CrSiTe3: a semiconducting two-dimensional ferromagnetic material

Computational prediction and characterization of single-layer CrS2

Softened Elastic Response and Unzipping in Chemical Vapor Deposition Graphene Membranes

Semiconducting SiGeSn high-entropy alloy: A density functional theory study

Machine-learning phase prediction of high-entropy alloys

Stable Lithium Electrodeposition at Ultra‐High Current Densities Enabled by 3D PMF/Li Composite Anode

Machine learning for phase selection in multi-principal element alloys

A "cation-anion regulation" synergistic anode host for dendrite-free lithium metal batteries

Enabling Stable Lithium Metal Anode via 3D Inorganic Skeleton with Superlithiophilic Interphase

Spin qubit based on the nitrogen-vacancy center analog in a diamond-like compound C3BN

Enhanced Li–S Batteries Using Amine-Functionalized Carbon Nanotubes in the Cathode

A Density Functional + U Assessment of Oxygen Evolution Reaction Mechanisms on β‑NiOOH

Electronic structures of single-layer boron pnictides

Ab initio synthesis of single-layer III-V materials

Toward obtaining 2D and 3D and 1D PtPN with pentagonal pattern

Layered tetragonal zinc chalcogenides for energy-related applications: from photocatalysts for water splitting to cathode materials for Li-ion batteries

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