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Preferential decomposition of the major anion in a dual-salt electrolyte facilitates the formation of organic-inorganic composite solid electrolyte interphase

The Journal of chemical physics, 2023-03, Vol.158 (10), p.104704-104704

2023

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In-Silico Screening the Nitrogen Reduction Reaction on Single-Atom Electrocatalysts Anchored on MoS2

Topics in catalysis, 2022-02, Vol.65 (1-4), p.234-241

2022

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Reaction mechanism on Ni-C2-NS single-atom catalysis for the efficient CO2 reduction reaction

Journal of experimental nanoscience, 2021-12, Vol.16 (1), p.255-264

2021

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Efficient CO Electroreduction to Methanol by CuRh Alloys with Isolated Rh Sites

ACS catalysis, 2023-06, Vol.13 (11), p.7170-7177

2023

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The DFT-ReaxFF Hybrid Reactive Dynamics Method with Application to the Reductive Decomposition Reaction of the TFSI and DOL Electrolyte at a Lithium–Metal Anode Surface

The journal of physical chemistry letters, 2021-02, Vol.12 (4), p.1300-1306

2021

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Effects of High and Low Salt Concentrations in Electrolytes at Lithium–Metal Anode Surfaces Using DFT-ReaxFF Hybrid Molecular Dynamics Method

The journal of physical chemistry letters, 2021-03, Vol.12 (11), p.2922-2929

2021

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In situ formation of circular and branched oligomers in a localized high concentration electrolyte at the lithium-metal solid electrolyte interphase: a hybrid ab initio and reactive molecular dynamics study

Journal of materials chemistry. A, Materials for energy and sustainability, 2022-01, Vol.10 (2), p.632-639

2022

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Promoting Mechanistic Understanding of Lithium Deposition and Solid‐Electrolyte Interphase (SEI) Formation Using Advanced Characterization and Simulation Methods: Recent Progress, Limitations, and Future Perspectives

Advanced energy materials, 2022-05, Vol.12 (19), p.n/a

2022

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DFT-ReaxFF hybrid molecular dynamics investigation of the decomposition effects of localized high-concentration electrolyte in lithium metal batteries: LiFSI/DME/TFEO

Physical chemistry chemical physics : PCCP, 2022-08, Vol.24 (31), p.18684-1869

2022

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formation of circular and branched oligomers in a localized high concentration electrolyte at the lithium-metal solid electrolyte interphase: a hybrid and reactive molecular dynamics study

Journal of materials chemistry. A, Materials for energy and sustainability, 2022-01, Vol.1 (2), p.632-639

2022

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Facet‐Selective Deposition of Ultrathin Al2O3 on Copper Nanocrystals for Highly Stable CO2 Electroreduction to Ethylene

Angewandte Chemie International Edition, 2021-11, Vol.60 (47), p.24838-24843

International ed. in English, 2021

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Predicted Operando Polymerization at Lithium Anode via Boron Insertion

ACS energy letters, 2021-06, Vol.6 (6), p.2320-2327

2021

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Facet‐Selective Deposition of Ultrathin Al 2 O 3 on Copper Nanocrystals for Highly Stable CO 2 Electroreduction to Ethylene

Angewandte Chemie (International ed.), 2021-11, Vol.60 (47), p.24838-24843

2021

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Facet-Selective Deposition of Ultrathin Al2 O3 on Copper Nanocrystals for Highly Stable CO2 Electroreduction to Ethylene

Angewandte Chemie (International ed.), 2021-11, Vol.60 (47), p.24838-24843

2021

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Fine-tuned molecular design toward a stable solid electrolyte interphase on a lithium metal anode from in silico simulation

Materials today chemistry, 2023-10, Vol.33, p.101735, Article 101735

2023

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Formation of Linear Oligomers in Solid Electrolyte Interphase via Two‐Electron Reduction of Ethylene Carbonate

Advanced theory and simulations, 2022-05, Vol.5 (5), p.n/a

2022

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Reaction mechanism on Ni-C 2 -NS single-atom catalysis for the efficient CO 2 reduction reaction

Journal of experimental nanoscience, 2021-01, Vol.16 (1), p.255-264

2021

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Facet‐Selective Deposition of Ultrathin Al 2 O 3 on Copper Nanocrystals for Highly Stable CO 2 Electroreduction to Ethylene

Angewandte Chemie, 2021-11, Vol.133 (47), p.25042-25047

2021

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Facet‐Selective Deposition of Ultrathin Al2O3 on Copper Nanocrystals for Highly Stable CO2 Electroreduction to Ethylene

Angewandte Chemie, 2021-11, Vol.133 (47), p.25042-25047

2021

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An active learning reliability analysis method using adaptive Bayesian compressive sensing and Monte Carlo simulation (ABCS-MCS)

Reliability engineering & system safety, 2022-05, Vol.221, p.108377, Article 108377

2022

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Data-driven determination of sample number and efficient sampling locations for geotechnical site investigation of a cross-section using Voronoi diagram and Bayesian compressive sampling

Computers and geotechnics, 2021-02, Vol.130, p.103898, Article 103898

2021

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Interpretation of spatio-temporal variation of precipitation from spatially sparse measurements using Bayesian compressive sensing (BCS)

Georisk, 2023-07, Vol.17 (3), p.554-571

2023

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Non-parametric generation of multivariate cross-correlated random fields directly from sparse measurements using Bayesian compressive sensing and Markov chain Monte Carlo simulation

Stochastic environmental research and risk assessment, 2023-12, Vol.37 (12), p.4607-4628

2023

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Effect of paeoniflorin on acute lung injury induced by influenza A virus in mice. Evidences of its mechanism of action

Phytomedicine (Stuttgart), 2021-11, Vol.92, p.153724-153724, Article 153724

2021

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Thermal adaptive behavior and thermal comfort for occupants in multi-person offices with air-conditioning systems

Building and environment, 2022-01, Vol.207, p.108432, Article 108432

2022

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Preferential decomposition of the major anion in a dual-salt electrolyte facilitates the formation of organic-inorganic composite solid electrolyte interphase

In-Silico Screening the Nitrogen Reduction Reaction on Single-Atom Electrocatalysts Anchored on MoS2

Reaction mechanism on Ni-C2-NS single-atom catalysis for the efficient CO2 reduction reaction

Efficient CO Electroreduction to Methanol by CuRh Alloys with Isolated Rh Sites

The DFT-ReaxFF Hybrid Reactive Dynamics Method with Application to the Reductive Decomposition Reaction of the TFSI and DOL Electrolyte at a Lithium–Metal Anode Surface

Effects of High and Low Salt Concentrations in Electrolytes at Lithium–Metal Anode Surfaces Using DFT-ReaxFF Hybrid Molecular Dynamics Method

In situ formation of circular and branched oligomers in a localized high concentration electrolyte at the lithium-metal solid electrolyte interphase: a hybrid ab initio and reactive molecular dynamics study

Promoting Mechanistic Understanding of Lithium Deposition and Solid‐Electrolyte Interphase (SEI) Formation Using Advanced Characterization and Simulation Methods: Recent Progress, Limitations, and Future Perspectives

DFT-ReaxFF hybrid molecular dynamics investigation of the decomposition effects of localized high-concentration electrolyte in lithium metal batteries: LiFSI/DME/TFEO

formation of circular and branched oligomers in a localized high concentration electrolyte at the lithium-metal solid electrolyte interphase: a hybrid and reactive molecular dynamics study

Facet‐Selective Deposition of Ultrathin Al2O3 on Copper Nanocrystals for Highly Stable CO2 Electroreduction to Ethylene

Predicted Operando Polymerization at Lithium Anode via Boron Insertion

Facet‐Selective Deposition of Ultrathin Al 2 O 3 on Copper Nanocrystals for Highly Stable CO 2 Electroreduction to Ethylene

Facet-Selective Deposition of Ultrathin Al2 O3 on Copper Nanocrystals for Highly Stable CO2 Electroreduction to Ethylene

Fine-tuned molecular design toward a stable solid electrolyte interphase on a lithium metal anode from in silico simulation

Formation of Linear Oligomers in Solid Electrolyte Interphase via Two‐Electron Reduction of Ethylene Carbonate

Reaction mechanism on Ni-C 2 -NS single-atom catalysis for the efficient CO 2 reduction reaction

Facet‐Selective Deposition of Ultrathin Al 2 O 3 on Copper Nanocrystals for Highly Stable CO 2 Electroreduction to Ethylene

Facet‐Selective Deposition of Ultrathin Al2O3 on Copper Nanocrystals for Highly Stable CO2 Electroreduction to Ethylene

An active learning reliability analysis method using adaptive Bayesian compressive sensing and Monte Carlo simulation (ABCS-MCS)

Data-driven determination of sample number and efficient sampling locations for geotechnical site investigation of a cross-section using Voronoi diagram and Bayesian compressive sampling

Interpretation of spatio-temporal variation of precipitation from spatially sparse measurements using Bayesian compressive sensing (BCS)

Non-parametric generation of multivariate cross-correlated random fields directly from sparse measurements using Bayesian compressive sensing and Markov chain Monte Carlo simulation

Effect of paeoniflorin on acute lung injury induced by influenza A virus in mice. Evidences of its mechanism of action

Thermal adaptive behavior and thermal comfort for occupants in multi-person offices with air-conditioning systems

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