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Dual-atom Pt heterogeneous catalyst with excellent catalytic performances for the selective hydrogenation and epoxidation

Nature communications, 2021-05, Vol.12 (1), p.3181-3181, Article 3181

2021

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Organic ligand mediated evolution from aluminum-based superalkalis to superatomic molecules and one-dimensional nanowires

Nano research, 2022-02, Vol.15 (2), p.1162-1170

2022

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Hydrated electrons as nodes in porous clathrate hydrates

The Journal of chemical physics, 2023-03, Vol.158 (11), p.114504-114504

2023

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Interplay between invasive single atom Pt and native oxygen vacancy in rutile TiO2(110) surface: A theoretical study

Nano research, 2022, Vol.15 (1), p.669-676

2022

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Molecular dynamics insights into electron-catalyzed dissociation repair of cyclobutane pyrimidine dimer

Chinese journal of chemical physics, 2021-12, Vol.34 (6), p.850-860

2021

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Mechanisms Responsible for High Energy Radiation Induced Damage to Single-Stranded DNA Modified by Radiosensitizing 5‑Halogenated Deoxyuridines

The journal of physical chemistry. B, 2016-03, Vol.120 (10), p.2649-2657

2016

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Achieving Real-Time Prediction of Paroxysmal Atrial Fibrillation Onset by Convolutional Neural Network and Sliding Window on R-R Interval Sequences

Bioengineering (Basel), 2024-09, Vol.11 (9), p.903

2024

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Ab initio molecular dynamics simulations reveal localization and time evolution dynamics of an excess electron in heterogeneous CO2-H2O systems

The Journal of chemical physics, 2014-01, Vol.140 (4), p.044318-044318

2014

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Large Equatorial Ligand Effects on C–H Bond Activation by Nonheme Iron(IV)-oxo Complexes

The journal of physical chemistry. B, 2014-02, Vol.118 (6), p.1493-1500

2014

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Water Promoting Electron Hole Transport between Tyrosine and Cysteine in Proteins via a Special Mechanism: Double Proton Coupled Electron Transfer

Journal of the American Chemical Society, 2014-03, Vol.136 (12), p.4515-4524

2014

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Redox-Regulated Magnetic Conversions between Ferro- and Antiferromagnetism in Organic Nitroxide Diradicals

Molecules (Basel, Switzerland), 2023-08, Vol.28 (17), p.6232

2023

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Proton-transfer regulated magnetic coupling characteristics in Blatter-based diradicals

New journal of chemistry, 2023-04, Vol.47 (14), p.693-6915

2023

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Intramolecular Proton Transfer Modulation of Magnetic Spin Coupling Interaction in Photochromic Azobenzene Derivatives with an Ortho-Site Hydroxyl as a Modulator

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2022-12, Vol.126 (49), p.9165-9177

2022

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Hydrogen-Bonding-Assisted Substituent Engineering for Modulating Magnetic Spin Couplings and Switching in m‑Phenylene Nitroxide Diradicals

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2023-09, Vol.127 (36), p.7443-7451

2023

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Enhanced J -Couplings through Specially Solvated Electron in Perfluoro-[ n ]Prismanes and [ n ]Asteranes

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2023-11, Vol.127 (46), p.9672-9683

2023

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A Ground-State Dual-Descriptor Strategy for Screening Efficient Singlet Fission Systems

The journal of physical chemistry letters, 2023-08, Vol.14 (32), p.7198-7207

2023

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Magnetic coupling modulation in meta -nitroxide-functionalized isoalloxazine magnets with redox-active units as efficient side-modulators

Physical chemistry chemical physics : PCCP, 2023-06, Vol.25 (25), p.16991-17000

2023

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Magnetic coupling modulation in -nitroxide-functionalized isoalloxazine magnets with redox-active units as efficient side-modulators

Physical chemistry chemical physics : PCCP, 2023-06, Vol.25 (25), p.16991-17

2023

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An Automatic System for Real-Time Identifying Atrial Fibrillation by Using a Lightweight Convolutional Neural Network

IEEE access, 2019, Vol.7, p.130074-130084

2019

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Selected-Control Hydrothermal Synthesis and Formation Mechanism of Monazite- and Zircon-Type LaVO4 Nanocrystals

The journal of physical chemistry. B, 2006-11, Vol.110 (46), p.23247-23254

2006

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TD-DFT Studies on sp- and sp2-Hybridized Single Vacancy-Defected [60]Fullerene: Electronic Excitation and Nonlinear Optical Properties of C59 [9-4] and C59 [8-5] Isomers

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-01, Vol.125 (1), p.106-114

2021

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Electronic Enhancement Effect of Copper Modification of Base Pairs on the Conductivity of DNA

Journal of physical chemistry. C, 2011-11, Vol.115 (45), p.22547-22556

2011

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Hydrated Electron Transfer to Nucleobases in Aqueous Solutions Revealed by Ab Initio Molecular Dynamics Simulations

Chemphyschem, 2015-08, Vol.16 (11), p.2348-2356

2015

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Indirect Nuclear Spin‐Spin Exchange Coupling through Solvated Electron in Small Sizes of Cyclic and Cage‐Shaped Perfluoroalkanes

Chemphyschem, 2023-06, Vol.24 (11), p.e202200923-n/a

2023

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Selective Synthesis and Luminescent Properties of Monazite- and Zircon-Type LaVO4:Ln (Ln = Eu, Sm, and Dy) Nanocrystals

Crystal growth & design, 2007-11, Vol.7 (11), p.2361-2366

2007

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Dual-atom Pt heterogeneous catalyst with excellent catalytic performances for the selective hydrogenation and epoxidation

Organic ligand mediated evolution from aluminum-based superalkalis to superatomic molecules and one-dimensional nanowires

Hydrated electrons as nodes in porous clathrate hydrates

Interplay between invasive single atom Pt and native oxygen vacancy in rutile TiO2(110) surface: A theoretical study

Molecular dynamics insights into electron-catalyzed dissociation repair of cyclobutane pyrimidine dimer

Mechanisms Responsible for High Energy Radiation Induced Damage to Single-Stranded DNA Modified by Radiosensitizing 5‑Halogenated Deoxyuridines

Achieving Real-Time Prediction of Paroxysmal Atrial Fibrillation Onset by Convolutional Neural Network and Sliding Window on R-R Interval Sequences

Ab initio molecular dynamics simulations reveal localization and time evolution dynamics of an excess electron in heterogeneous CO2-H2O systems

Large Equatorial Ligand Effects on C–H Bond Activation by Nonheme Iron(IV)-oxo Complexes

Water Promoting Electron Hole Transport between Tyrosine and Cysteine in Proteins via a Special Mechanism: Double Proton Coupled Electron Transfer

Redox-Regulated Magnetic Conversions between Ferro- and Antiferromagnetism in Organic Nitroxide Diradicals

Proton-transfer regulated magnetic coupling characteristics in Blatter-based diradicals

Intramolecular Proton Transfer Modulation of Magnetic Spin Coupling Interaction in Photochromic Azobenzene Derivatives with an Ortho-Site Hydroxyl as a Modulator

Hydrogen-Bonding-Assisted Substituent Engineering for Modulating Magnetic Spin Couplings and Switching in m‑Phenylene Nitroxide Diradicals

Enhanced J -Couplings through Specially Solvated Electron in Perfluoro-[ n ]Prismanes and [ n ]Asteranes

A Ground-State Dual-Descriptor Strategy for Screening Efficient Singlet Fission Systems

Magnetic coupling modulation in meta -nitroxide-functionalized isoalloxazine magnets with redox-active units as efficient side-modulators

Magnetic coupling modulation in -nitroxide-functionalized isoalloxazine magnets with redox-active units as efficient side-modulators

An Automatic System for Real-Time Identifying Atrial Fibrillation by Using a Lightweight Convolutional Neural Network

Selected-Control Hydrothermal Synthesis and Formation Mechanism of Monazite- and Zircon-Type LaVO4 Nanocrystals

TD-DFT Studies on sp- and sp2-Hybridized Single Vacancy-Defected [60]Fullerene: Electronic Excitation and Nonlinear Optical Properties of C59 [9-4] and C59 [8-5] Isomers

Electronic Enhancement Effect of Copper Modification of Base Pairs on the Conductivity of DNA

Hydrated Electron Transfer to Nucleobases in Aqueous Solutions Revealed by Ab Initio Molecular Dynamics Simulations

Indirect Nuclear Spin‐Spin Exchange Coupling through Solvated Electron in Small Sizes of Cyclic and Cage‐Shaped Perfluoroalkanes

Selective Synthesis and Luminescent Properties of Monazite- and Zircon-Type LaVO4:Ln (Ln = Eu, Sm, and Dy) Nanocrystals

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