Lei Li

发表

Coordination-resolved electron spectrometrics.

Maolin Bo, Xi Zhang, Weitao Zheng, 2015, Chemical reviews.

TiO2 Band Restructuring by B and P Dopants

Chang Q. Sun, Weitao Zheng, Xiaoying Hu, 2016, PloS one.

ZnIn2S4 flowerlike microspheres embedded with carbon quantum dots for efficient photocatalytic reduction of Cr(VI)

Xinjuan Liu, Xinsheng Zhao, Lengyuan Niu, 2018, Chinese Journal of Catalysis.

Structures and Anomalies of Water

Zengsheng Ma, Changqing Sun, Xi Zhang, 2018, 1811.11234.

Cu2In2ZnS5/Gd2O2S:Tb for full solar spectrum photoreduction of Cr(VI) and CO2 from UV/vis to near-infrared light

Chang Q. Sun, Xinjuan Liu, Lengyuan Niu, 2019, Applied Catalysis B: Environmental.

Atomic configuration of hydrogenated and clean tantalum(111) surfaces: Bond relaxation, energy entrapment and electron polarization

Maolin Bo, Cheng Peng, Changqing Sun, 2018 .

Cr(VI) reduction in presence of ZnS/RGO photocatalyst under full solar spectrum radiation from UV/vis to near-infrared light

L. Pan, Xinjuan Liu, Lengyuan Niu, 2018, Catalysis Today.

Bond−Energy−Electron Relaxation of BeN Nanoclusters and BeX Alloys

Maolin Bo, Cheng Peng, Junquan Zhou, 2018, Advanced Theory and Simulations.

Adsorption of NO and NO 2 on Rh‐Doped Hexagonal Boron Nitride Monolayers: A First‐Principles Study

Qingwei Zhang, Lei Li, Yunhua Lu, 2021, ChemistrySelect.

Electronic Structure and Bond Relaxation at Na/Ta(110) Interfaces and 1D‐Chain and 2D‐Ring Ta Metal Structures on Na(110)

Chang Q. Sun, Maolin Bo, Cheng Peng, 2018, physica status solidi (b).

Perturbative vibration of the coupled hydrogen-bond (O:H-O) in water.

J. Ou, Wen Li, Lei Li, 2022, Advances in colloid and interface science.

NiS sheets modified CdS/reduced graphene oxide composite for efficient visible light photocatalytic hydrogen evolution

L. Pan, Xinjuan Liu, Can Li, 2018, Catalysis Today.

Isomerization of two-dimensional non-fullerene electron acceptor materials for developing high-performance organic solar cells

Maolin Bo, Jinshan Wang, Lei Li, 2022, Journal of Materials Chemistry C.

Oxygenation mediating the valence density-of-states and work function of Ti(0001) skin.

Chang Q. Sun, Xiaoying Hu, H. Tian, 2015, Physical chemistry chemical physics : PCCP.

Multifield-resolved phonon spectrometrics: structured crystals and liquids

Chang Q. Sun, Maolin Bo, Cheng Peng, 2019, Progress in Solid State Chemistry.

All-solid-state Z-scheme CdTe/TiO2 heterostructure photocatalysts with enhanced visible-light photocatalytic degradation of antibiotic waste water

Xinjuan Liu, Lengyuan Niu, Can Li, 2018, Chemical Engineering Journal.

Elucidating the key role of fluorine in improving the charge mobility of electron acceptors for non-fullerene organic solar cells by multiscale simulations

Maolin Bo, Cheng Peng, Jinshan Wang, 2018 .

Supersolid Skin Mechanics of Water and Ice

Chang Q. Sun, Sanmei Wang, Xi Zhang, 2017 .

Sensing Properties of Vacancy and Pd-Doped Graphene Layer: A First-Principles Study

Qingwei Zhang, Lei Li, Yunhua Lu, 2021 .

CaIn2S4 decorated WS2 hybrid for efficient Cr(VI) reduction

Chang Q. Sun, Xinjuan Liu, Lengyuan Niu, 2019, Applied Surface Science.

The effects of local bond relaxations on the electronic and photocatalysis performances of nonmetal doped 3R–MoS2 based photocatalyst: density functional theory

Tao Wang, Huanhuan Li, Xinjuan Liu, 2017 .

Discriminative ionic polarizability of alkali halide solutions: hydration cells, bond distortion, surface stress, and viscosity

Maolin Bo, Lei Li, Yongli Huang, 2021, Journal of Molecular Liquids.

Energy absorbancy and freezing-temperature tunability of NaCl solutions during ice formation

K. Ostrikov, Yongzhi Wang, Lei Li, 2021, Journal of Molecular Liquids.

Mechanistic insights into NO‒H2 reaction over Pt/boron-doped graphene catalyst.

Kai Hui, K. Hui, Xuguang Liu, 2020, Journal of Hazardous Materials.

Hydrogen-bond transition from the vibration mode of ordinary water to the (H, Na)I hydration states: Molecular interactions and solution viscosity

Chang Q. Sun, Xi Zhang, Xinjuan Liu, 2018 .

Larger VH (Hole Distribution Volume)/VM (Molecular Volume) Induced Higher Charge Mobility of Group IVA Element-Based Host Materials for Potentially Highly Efficient Blue OLEDs

Maolin Bo, Cheng Peng, Jinshan Wang, 2018, The Journal of Physical Chemistry C.

Elucidating the Key Role of the Cyano (−C≡N) Group to Construct Environmentally Friendly Fused-Ring Electron Acceptors

Maolin Bo, Cheng Peng, Jinshan Wang, 2020 .

Adjustable photocatalytic ability of monolayer g-C3N4 utilizing single–metal atom: Density functional theory

Yuehua Wu, Tao Wang, Huanhuan Li, 2018, Applied Surface Science.

Functionalizing triptycene to create 3D high-performance non-fullerene acceptors

Maolin Bo, Cheng Peng, Jinshan Wang, 2020, RSC advances.

Ge-based bipolar small molecular host for highly efficient blue OLEDs: multiscale simulation of charge transport

Maolin Bo, Cheng Peng, Jinshan Wang, 2018 .

Bond relaxation and electronic and magnetic properties of Sc atoms adsorbed on the Li (1 1 0) surface

Maolin Bo, Cheng Peng, Zhongkai Huang, 2020 .

Replacing the cyano (-C[triple bond, length as m-dash]N) group to design environmentally friendly fused-ring electron acceptors.

Maolin Bo, Cheng Peng, Jinshan Wang, 2021, Physical chemistry chemical physics : PCCP.

Quad-rotor-shaped non-fullerene electron acceptor materials with potential to enhance the photoelectric performance of organic solar cells

Maolin Bo, Cheng Peng, Jinshan Wang, 2019, Journal of Materials Chemistry A.

Heterojunction bond relaxation and electronic reconfiguration of WS2- and MoS2-based 2D materials using BOLS and DFT

Maolin Bo, Cheng Peng, Junquan Zhou, 2018, Applied Surface Science.

Energy absorbency and phase stability during NaCl solution icing

Xin Wei, Yongzhi Wang, Lei Li, 2021, 2109.09442.

Bond relaxation and electronic properties of two-dimensional Sb/MoSe2 and Sb/MoTe2 van der Waals heterostructures

Maolin Bo, Hanze Li, Zhongkai Huang, 2019, 1910.01873.

Nitrogen mediated electronic structure of the Ti(0001) surface

Chang Q. Sun, Xiaoying Hu, L. Qiao, 2016 .

Understanding atomic bonding and electronic distributions of a DNA molecule using DFT calculation and BOLS-BC model

Maolin Bo, Hanze Li, Zhongkai Huang, 2020, Biochemistry and biophysics reports.

Bond states, moiré patterns, and bandgap modulation of two-dimensional BN/SiC van der Waals heterostructures

Maolin Bo, Cheng Peng, Hanze Li, 2020 .

Electronic structure of two-dimensional In and Bi metal on BN nanosheets

Chang Q. Sun, Maolin Bo, Cheng Peng, 2019, RSC advances.

Atomic bonding and binding energy of two-dimensional Bi/Li(110) heterojunctions via BOLS and BB model

Liangjin Ge, Maolin Bo, Jibiao Li, 2020, 2008.06382.

Electronic and magnetic properties of twisted silver and palladium nanorods using density functional theory

Liangjin Ge, Maolin Bo, Hanze Li, 2021, Chemical Physics Letters.

Non-fullerene electron acceptors constructed by four strong electron-withdrawing end groups: Potential to improve the photoelectric performance of organic solar cells by theoretical investigations

Maolin Bo, Cheng Peng, Jinshan Wang, 2020 .