C. Hao

发表

Understanding the Inhibition of the Shuttle Effect of Sulfides (S ≤ 3) in Lithium–Sulfur Batteries by Heteroatom-Doped Graphene: First-Principles Study

Benjie Gong, Xuedan Song, Yantao Shi, 2020 .

Ionic liquid induced electrostatic self-assemble of reduced graphene oxide for high-performance all-solid-state flexible symmetric supercapacitor

Feng Liu, Na Wu, C. Hao, 2019, Journal of Alloys and Compounds.

One-Step Activation Synthesized Hierarchical Porous Carbon Spheres from Resorcinol–Thiourea–Formaldehyde for Electrochemical Capacitors

Xuedan Song, C. Hao, Weiwei Qiu, 2020 .

Phosphorized SnO2/graphene heterostructures for highly reversible lithium-ion storage with enhanced pseudocapacitance

G. Cao, Malin Li, Hong-En Wang, 2018 .

In-situ liquid cell transmission electron microscopy investigation on oriented attachment of gold nanoparticles

K. Yin, Litao Sun, Tong Zhang, 2018, Nature Communications.

Highly accessible hierarchical porous carbon from a bi-functional ionic liquid bulky gel: high-performance electrochemical double layer capacitors

T. Ma, Hongxia Wang, C. Hao, 2019, Journal of Materials Chemistry A.

Electroactive edge site-enriched nickel–cobalt sulfide into graphene frameworks for high-performance asymmetric supercapacitors

Juan-Yu Yang, Xiaoming Fan, Chang Yu, 2016 .

A heterostuctured Co3S4/MnS nanotube array as a catalytic sulfur host for lithium–sulfur batteries

Fengxiang Zhang, Yongpeng Li, Fengxiang Zhang, 2020 .

Online in-situ monitoring of melt pool characteristic based on a single high-speed camera in laser powder bed fusion process

Zhanwei Liu, Jiangfan Zhou, C. Hao, 2022, Applied Thermal Engineering.

Real-time measurement method of melt pool temperature in the directed energy deposition process

Huimin Xie, Zhanwei Liu, Sheng Liu, 2020 .

Role of water oxidation in the photoreduction of graphene oxide.

Xuedan Song, Yantao Shi, C. Hao, 2019, Chemical communications.

Enhancing oxygen reduction reaction durability via coating graphene layers on iron-nitrogen supported carbon nanotubes

C. Hao, Si-Mei Chen, Cai Liu, 2016 .

The oxygen sensing mechanism of a triphenylamine-based cyclometalated platinum(II) complex

Xuedan Song, C. Hao, Tianqing Liu, 2019, Journal of Luminescence.

Dynamic motion of La atom inside the C74 (D3h) cage: a relativistic DFT study

C. Hao, Suzhen Ren, D. Tian, 2013, Journal of Molecular Modeling.

Role of the electronic excited-state hydrogen bonding in the nitro-explosives detection by [Zn2(oba)2(bpy)]

Xuedan Song, C. Hao, Lei Liu, 2016 .

New insights into the nitroaromatics-detection mechanism of the luminescent metal-organic framework sensor.

J. Qiu, C. Hao, Xiaofang Chen, 2015, Dalton transactions.

Vector correlations in the F + HO → HF + O reaction and its isotopic variant

C. Hao, T. Chu, Dan Zhao, 2012, Journal of Molecular Modeling.

Amorphous Inorganic Electron‐Selective Layers for Efficient Perovskite Solar Cells: Feasible Strategy Towards Room‐Temperature Fabrication

T. Ma, Shufeng Wang, Yantao Shi, 2016, Advanced materials.

Bridging of Ultrathin NiCo2O4 Nanosheets and Graphene with Polyaniline: A Theoretical and Experimental Study

P. Ajayan, Juan-Yu Yang, Chang Yu, 2016 .

A 2D covalent organic framework as a sensor for detecting formaldehyde

C. Hao, Yang Yan, Zhengyan Zhao, 2018, Journal of Molecular Modeling.

Designing three-dimensional hierarchical porous chrysanthemum flower-like CoNiFe2O4/carbon spheres as high-performance electrode for supercapacitors and oxygen reduction reaction

Shehnaz, C. Hao, Suzhen Ren, 2021, Journal of Materials Science: Materials in Electronics.

Dual Sites of CoO Nanoparticles and Co–Nx Embedded within Coal-Based Support toward Advanced Triiodide Reduction

Danyang Wu, Xuedan Song, Yantao Shi, 2019, ACS Sustainable Chemistry & Engineering.

Fabrication of Supercapacitors using Carbon Microspheres Synthesized from Resorcinol–Formaldehyde Resin

Xuzhen Wang, C. Hao, Suzhen Ren, 2013 .

Guanidimidazole-quanternized and cross-linked alkaline polymer electrolyte membrane for fuel cell application

Fengxiang Zhang, Kuibo Zhang, G. He, 2016 .

Hydrophilic side chain assisting continuous ion-conducting channels for anion exchange membranes

Issam El Hamouti, G. He, C. Hao, 2018 .

Improvement of alkaline stability for hydroxide exchange membranes by the interactions between strongly polar nitrile groups and functional cations

Issam El Hamouti, G. He, C. Hao, 2017 .

In-situ synthesis of Co nanoparticles encapsulated in mesoporous Co, N-codoped graphene-like carbon hybrid as an efficient oxygen reduction electrocatalyst

Xuedan Song, Yantao Shi, C. Hao, 2021 .

Carrier dynamics in CsPbI3 perovskite microcrystals synthesized in solution phase

C. Hao, Shengye Jin, Jinwen Hu, 2017 .

The Power of Single‐Atom Catalysis

Yantao Shi, C. Hao, Suxia Liang, 2015 .

Cobalt-embedded nitrogen-doped hollow carbon nanorods for synergistically immobilizing the discharge products in lithium–sulfur battery

Chang Yu, J. Qiu, Xuedan Song, 2016 .

Structure determination of a missing-caged metallofullerene: Yb@C74 (II) and the dynamic motion of the encaged ytterbium ion

Z. Gu, Zujin Shi, C. Hao, 2006 .

Melt-salt-assisted direct transformation of solid oxide into atomically dispersed FeN4 sites on nitrogen-doped porous carbon

Danyang Wu, Yantao Shi, C. Hao, 2020 .

The dual-luminescence mechanism of the ESIPT chemosensor tetrasubstituted imidazole core compound: a TDDFT study

Na Qiao, C. Hao, Ning-Ning Wei, 2018 .

A sensor for formaldehyde detection: luminescent metal–organic framework [Zn2(H2L)(2,2′-bpy)2(H2O)]n

Xuedan Song, C. Hao, Suzhen Ren, 2015 .

Theoretical study of the interaction between X (H, F) and graphene

J. Qiu, C. Hao, Suzhen Ren, 2014 .

The dynamic motion of a M (M = Ca, Yb) atom inside the C74 (D3h) cage: a relativistic DFT study

C. Hao, Suzhen Ren, D. Tian, 2013, Journal of Molecular Modeling.

Insight into the photocatalytic mineralization of short chain chlorinated paraffins boosted by polydopamine and Ag nanoparticles.

Xinyong Li, Qidong Zhao, Yong Shi, 2018, Journal of hazardous materials.

Synthesis of hollow donut-like carbon nitride for the visible light-driven highly efficient photocatalytic production of hydrogen and degradation of pollutants

Xuedan Song, C. Hao, Sihang Liu, 2020 .

Onion-like graphitic carbon covering metallic nanocrystals derived from brown coal as a stable and efficient counter electrode for dye-sensitized solar cells

Xuedan Song, Yantao Shi, C. Hao, 2019, Journal of Power Sources.

Sn@SnO2 attached on carbon spheres as additive-free electrode for high-performance pseudocapacitor

Xuedan Song, C. Hao, Suzhen Ren, 2016 .

The synthesis of ordered Sn–C composite microspheres and their mechanical properties

C. Hao, Suzhen Ren, Ying Yang, 2015 .

Sulfur encapsulated in a wafer-like carbon substrate with interconnected meso/micropores for high-performance lithium–sulfur batteries

C. Hao, Yang Yan, Xiao-Feng Hao, 2019 .

Tangerine peel-derived carbon supported manganese oxides catalyst for oxygen reduction reaction

C. Hao, Chen Wenwen, Cai Liu, 2018, Applied Surface Science.

Molten salt as ultrastrong polar solvent enables the most straightforward pyrolysis towards highly efficient and stable single-atom electrocatalyst

Wei Liu, Danyang Wu, Yantao Shi, 2021, Journal of Energy Chemistry.

Promotion of oxygen reduction performance by Fe3O4 nanoparticles support nitrogen -doped three dimensional meso/macroporous carbon based electrocatalyst

C. Hao, Si-Mei Chen, Cai Liu, 2017 .

TDDFT study on recognition mechanism for the oxygen sensing of the cyclometalated platinum (II) complex.

Chenyang Zhou, Peng Li, C. Hao, 2017, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

DFT study on 1,7-octadiene polymerization catalyzed by a non-bridged half-titanocene system

G. He, C. Hao, Xiaodong Zhu, 2016 .

Roles of hydrogen bonds and π–π stacking in the optical detection of nitro-explosives with a luminescent metal–organic framework as the sensor

Yantao Shi, C. Hao, Lei Liu, 2015 .

Interaction between formaldehyde and luminescent MOF [Zn(NH₂bdc)(bix)]n in the electronic excited state.

Xuedan Song, C. Hao, Yuhang Yao, 2014, The journal of physical chemistry. A.

Hydrogen bonding and coordination bonding in the electronically excited states of the MOF Cu2 (L)2 (L=5-(4-pyridyl)tetrazole) CH2Cl2: A time-dependent density functional theory study

C. Hao, M. Ji, Xiao Sui, 2013 .

Hexylammonium Iodide Derived 2D Perovskite as Interfacial Passivation Layer in Efficient 2D/3D Perovskite Solar Cells.

Yanfeng Yin, Xuedan Song, Yantao Shi, 2019, ACS applied materials & interfaces.

Novel carbon quantum dots for fluorescent detection of phenol and insights into the mechanism

C. Hao, Yang Yan, Li Guanglan, 2018 .

Direct transformation of raw biomass into a Fe–Nx–C single-atom catalyst for efficient oxygen reduction reaction

Wei Liu, Danyang Wu, Yantao Shi, 2021 .

Salt melt synthesis of Chlorella-derived nitrogen-doped porous carbon with atomically dispersed CoN4 sites for efficient oxygen reduction reaction.

Danyang Wu, Yantao Shi, C. Hao, 2020, Journal of colloid and interface science.

Ionothermal synthesis of graphene-based microporous carbon for lithium–sulfur batteries

C. Hao, Yang Yan, Nan Cui, 2018 .

HYDROGEN STORAGE IN HETEROJUNCTION CARBON NANOTUBES : MOLECULAR DYNAMICS STUDY

C. Hao, Hongli Wu, J. Qiu, 2004 .

Hollow SnO2 microspheres and their carbon-coated composites for supercapacitors

Xuzhen Wang, C. Hao, Suzhen Ren, 2014 .

LCOFs: Role of the excited state hydrogen bonding in the detection for nitro-explosives

Xuedan Song, C. Hao, Yao Xu, 2019, Journal of Luminescence.

A mechanism of the luminescent covalent organic framework for the detection of NH3

Yanan Yang, C. Hao, Yang Yan, 2019, New Journal of Chemistry.

Field-free orientation of CO molecule by combining two-color femtosecond laser pulse with time-delayed positively chirped laser pulse

C. Hao, Shuo Wang, W. Zhan, 2018, The European Physical Journal D.

Effects of 4-tert-butylpyridine on perovskite formation and performance of solution-processed perovskite solar cells

T. Ma, Yantao Shi, C. Hao, 2015 .

TD-DFT insights into the sensing potential of the luminescent covalent organic framework for indoor pollutant formaldehyde.

Xuedan Song, C. Hao, S. Shah, 2020, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Important role of reaction field in photodegradation of deca-bromodiphenyl ether: theoretical and experimental investigations of solvent effects.

C. Hao, Jingwen Chen, Hongxia Zhao, 2009, Chemosphere.

Molecular structure simplification of the most common hole transport materials in perovskite solar cells

Huicai Ren, Yuan Xue, Yantao Shi, 2016 .

Synergistic effect of heat treatment and concentration of polydopamine enhance the electrochemical performances of hollow nitrogen-doped carbon microspheres

Xuedan Song, C. Hao, Suzhen Ren, 2019, Ionics.

Molecular simulation of adsorption of NO and CO2 mixtures by a Cu-BTC metal organic framework

Xuedan Song, Yantao Shi, C. Hao, 2015 .

Investigation of SO2 gas adsorption in metal–organic frameworks by molecular simulation

Xuedan Song, C. Hao, J. Qiu, 2014 .

Theoretical studies on how excited state hydrogen and coordination bonds affect luminescent properties of Metal Organic Framework Cu4(L)4•2EtOH

C. Hao, Lei Liu, Weihong Mi, 2013 .

Hydrogen bonding and coordination bonding in the electronically excited states of Cu2(L)2 (L=5-(4-pyridyl)tetrazole)MeOH: a TDDFT study.

Yao Meng, C. Hao, M. Ji, 2013, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Quaternary-ammonium-immobilized polystyrenes as efficient and reusable heterogeneous catalysts for synthesis of cyclic carbonate: Effects of linking chains and pendent hydroxyl group

Xuan Ding, Wenji Zheng, G. He, 2017 .

Theoretical insight into the carrier mobility anisotropy of hole transport material Spiro-OMeTAD

Yuan Xue, Xuedan Song, Yantao Shi, 2017 .

Well-defined heteroatom-rich porous carbon electrocatalyst derived from biowaste for high-performance counter electrode in dye-sensitized solar cells

Danyang Wu, Xuedan Song, Yantao Shi, 2018, Electrochimica Acta.

ZIF-67 Derived Nanostructures of Co/CoO and Co@N-doped Graphitic Carbon as Counter Electrode for Highly Efficient Dye-sensitized Solar Cells

Ming Feng, Xuedan Song, Yantao Shi, 2016 .

Metal–organic frameworks HKUST-1 as porous matrix for encapsulation of basic ionic liquid catalyst: effect of chemical behaviour of ionic liquid in solvent

C. Hao, Sang-Eon Park, M. Ji, 2015, Journal of Porous Materials.

Organic electron-rich N-heterocyclic compound as a chemical bridge: building a Brönsted acidic ionic liquid confined in MIL-101 nanocages

C. Hao, Yanqin Li, M. Ji, 2013 .

Effect of 4-tert-butylpyridine on Perovskite Formation and Performance of Solution-Processed Perovskite Solar Cells

T. Ma, Yantao Shi, C. Hao, 2015 .

Effects of excited-state structures and properties on photochemical degradation of polybrominated diphenyl ethers: a TDDFT study.

C. Hao, Jingwen Chen, Zhanxian Gao, 2012, Chemosphere.

Theoretical insight into the carrier mobility anisotropy of organic-inorganic perovskite CH 3 NH 3 PbI 3

Yuan Xue, Xuedan Song, Yantao Shi, 2018 .

The Structural Design of Dual‐Element‐Doped Graphene for Iodine Reduction Reaction: Density Functional Theory Study

C. Hao, Hanyu Xu, Yiping Zhong, 2022, ChemistrySelect.

Graphene-mediated highly-dispersed MoS2 nanosheets with enhanced triiodide reduction activity for dye-sensitized solar cells

P. Ajayan, T. Ma, Gang Wang, 2016 .

Density functional theory study of direct and indirect photodegradation mechanisms of sulfameter

C. Hao, S. Shah, 2016, Environmental Science and Pollution Research.

Single-atom-catalyst with abundant Co-S4 sites for use as a counter electrode in photovoltaics.

Yantao Shi, C. Hao, Nannan Li, 2021, Chemical communications.

Theoretical Insights into the Carrier Mobility Anisotropy of Organic–Inorganic Perovskite ABI3 (A = CH3NH3 and HC(NH2)2; B = Pb and Sn)

Yantao Shi, C. Hao, M. Ji, 2021, The Journal of Physical Chemistry C.

Enhanced photoactivities of TiO2 particles induced by bio-inspired micro-nanoscale substrate.

T. Ma, C. Hao, Yang Yan, 2016, Journal of colloid and interface science.

Molecular size- and shape-selective Knoevenagel condensation over microporous Cu3(BTC)2 immobilized amino-functionalized basic ionic liquid catalyst

Xuedan Song, C. Hao, Sang-Eon Park, 2014 .

Synergistic effect of heat treatments and KOH activation enhances the electrochemistry performance of polypyrrole nanochains (PPy-NCs)

Shehnaz, Xuedan Song, C. Hao, 2018 .

Enhanced sodium storage in strongly-combined MoS2/rGO nanocomposite: Constructed by ionic liquid induced layer-by-layer self-assembly

Jianhui Liu, C. Hao, Yang Yan, 2020 .

Time-Dependent Density Functional Theory Study on Hydrogen and Dihydrogen Bonding in Electronically Excited State of 2-Pyridone–Borane–Trimethylamine Cluster

A. Hamza, Z. Xiu, C. Hao, 2013, Journal of Cluster Science.

TIME-DEPENDENT DENSITY FUNCTIONAL THEORY STUDY ON THE ELECTRONIC EXCITED-STATE HYDROGEN BONDING DYNAMICS OF METHYL ACETATE IN AQUEOUS SOLUTION

C. Hao, Mingzhen Zhang, Ning-Ning Wei, 2011 .

Role of the intermolecular and intramolecular hydrogen bonding on the excited-state proton transfer behavior of 3-aminophthalimide (3AP) dimer

C. Hao, Jingwen Chen, Meihua Ge, 2011 .

A theoretical forecast of the hydrogen bond changes in the electronic excited state for BN and its derivatives

C. Hao, J. Qiu, S. Wang, 2012 .

Co 3 O 4 nanoparticles assembled on polypyrrole/graphene oxide for electrochemical reduction of oxygen in alkaline media

Xuedan Song, C. Hao, Q. Mao, 2017 .

Sidewall fluorination and hydrogenation of single-walled carbon nanotubes: a density functional theory study

Jijun Zhao, C. Hao, J. Qiu, 2009 .

Role of the electronically excited-state hydrogen bonding and water clusters in the luminescent metal-organic framework.

C. Hao, M. Ji, Xiao Sui, 2013, Inorganic chemistry.

Styrylcyanine-based fluorescent probes with red-emission and large Stokes shift for the detection of viscosity

Jianhui Liu, C. Hao, Xiang-Jian Cao, 2017 .

Two (5,5)-connected isomeric frameworks as highly selective and sensitive photoluminescent probes of nitroaromatics

Jianjun Zhang, Xuedan Song, C. Hao, 2017 .

MOF-derived metal/carbon materials as oxygen evolution reaction catalysts

C. Hao, Suzhen Ren, Sumbal Farid, 2018, Inorganic Chemistry Communications.

Luminescent properties of metal-organic framework MOF-5: relativistic time-dependent density functional theory investigations.

C. Hao, M. Ji, Xin Lan, 2012, Inorganic chemistry.

PdCl2 immobilized on metal–organic framework CuBTC with the aid of ionic liquids: enhanced catalytic performance in selective oxidation of cyclohexene

C. Hao, Sang-Eon Park, Yanqin Li, 2016 .

SO2 adsorption and transformation on calcined NiAl hydrotalcite-like compounds surfaces: An in situ FTIR and DFT study

Xinyong Li, C. Raston, C. Hao, 2012 .

Organic/inorganic hybrid quaternary ionogel electrolyte with low lithium-ion association and uniform lithium flux for lithium secondary batteries

T. Ma, C. Hao, Anmin Liu, 2022, Electrochimica Acta.

Promoting the Oxygen Evolution Reaction via Morphological Manipulation of a Lamellar Nanorod-Assembled Ni(II)-Pyrazolate Superstructure.

C. Hao, Q. Mao, Suzhen Ren, 2022, ACS applied materials & interfaces.

Excited state intermolecular hydrogen bond’s effect on the luminescent behaviour of the 2D covalent organic framework (PPy-COF): A TDDFT insight

Xuedan Song, C. Hao, Jianzhang Zhao, 2019, Molecular Simulation.

Research Progress of Carbon-Supported Metal Single Atom Catalysts for Oxygen Reduction Reaction

Wei Liu, Yantao Shi, C. Hao, 2021, Journal of Inorganic Materials.

Facile synthesis of efficient core-shell structured iron-based carbon catalyst for oxygen reduction reaction

C. Hao, Qiu-mei Wu, Chen Wenwen, 2018 .

Pitch-derived carbon quantum dots as fluorescent probe for selective and sensitive detection of ferric ions and bioimaging

Xuedan Song, Yantao Shi, C. Hao, 2021 .

FeNi Alloy Nanoparticles Encapsulated in Carbon Shells Supported on N-Doped Graphene-Like Carbon as Efficient and Stable Bifunctional Oxygen Electrocatalysts.

Xuedan Song, Yantao Shi, C. Hao, 2020, Chemistry.

N/S/B-doped graphitized carbon encased Fe species as a highly active and durable catalyst towards oxygen reduction reaction.

C. Hao, Cai Liu, G. Cheng, 2018, Journal of colloid and interface science.

Efficient Synthesis of Nitrogen- and Sulfur-co-Doped Ketjenblack with a Single-Source Precursor for Enhancing Oxygen Reduction Reaction Activity.

C. Hao, Cai Liu, G. Cheng, 2017, Chemistry.

FePc nanoclusters modified NiCo layered double hydroxides on Ti3C2 MXene as a highly efficient and durable bifunctional oxygen electrocatalyst for zinc-air batteries

C. Hao, Yang Yan, Xin Wang, 2022, Applied Surface Science.

Hydroxide degradation pathways for guanidimidazolium cation: A density functional theory study

Fengxiang Zhang, C. Hao, Jie Cheng, 2018, Journal of Physical Organic Chemistry.

Hydroxide ion transfer in anion exchange membrane: A density functional theory study

Fengxiang Zhang, G. He, C. Hao, 2016 .

Enhanced dyes removal properties of hollow SnO2 Microspheres and SnO2@C composites

C. Hao, Suzhen Ren, Ying Yang, 2015 .

Fabrication of high-performance supercapacitors based on hollow SnO2 microspheres

C. Hao, Suzhen Ren, Ying Yang, 2014, Journal of Solid State Electrochemistry.

Efficient hierarchically synthesized Fe2P nanoparticles embedded in an N,P-doped mesoporous carbon catalyst for the oxygen reduction reaction

C. Hao, Chen Wenwen, Cai Liu, 2018 .

The interaction between D3h-C74 and fluorine

C. Hao, Hongjiang Li, J. Qiu, 2011 .

Dechlorination of chloroacetanilide herbicides by plant growth regulator sodium bisulfite.

Liping Huang, C. Hao, Jingwen Chen, 2009, Water research.

Effect of hydrogen bonding on self-diffusion in methanol/water liquid mixtures: A molecular dynamics simulation study

G. He, C. Hao, Ning Zhang, 2015 .

A Novel Single‐Atom Electrocatalyst Ti1/rGO for Efficient Cathodic Reduction in Hybrid Photovoltaics

Shuo Zhang, Chao Zhu, Xuedan Song, 2020, Advanced materials.

Endohedral metalloborofullerenes La2@B80 and Sc3N@B80: a density functional theory prediction.

Shengbai Zhang, Zhongfang Chen, C. Hao, 2009, The journal of physical chemistry. A.

Polyaniline–derived metal–free hollow nitrogen–doped carbon microspheres as an efficient electrocatalyst for supercapacitors and oxygen reduction

Xuedan Song, C. Hao, Weiwei Qiu, 2018, Journal of Electroanalytical Chemistry.

Hydrogen bond-induced bright enhancement of fluorescent silica cross-linked micellar nanoparticles.

Q. Huo, C. Hao, Y. Ao, 2018, Journal of colloid and interface science.

Supercapacitive and ORR performances of nitrogen-doped hollow carbon spheres pyrolyzed from polystyrene@polypyrrole-polyaniline

Xuedan Song, C. Hao, Weiwei Qiu, 2020 .

Insight into the Activity and Stability of Transition-Metal Atoms Embedded in MnO for Triiodide Reduction Reaction

Danyang Wu, Xuedan Song, Yantao Shi, 2019, ACS Sustainable Chemistry & Engineering.

Role of intramolecular hydrogen bonding in the excited-state intramolecular double proton transfer (ESIDPT) of calix[4]arene: A TDDFT study

C. Hao, Zhuang Wang, S. Wang, 2016 .

One-step construction of porous mixed spinel-type MnCoxO4/NCNT as an efficient bi-functional oxygen electrocatalyst

C. Hao, Chen Wenwen, Cai Liu, 2018, International Journal of Hydrogen Energy.

3D fluorescent cucurbit[7]uril framework linked by anion fluorophore

C. Hao, Li Liu, Zhengyan Zhao, 2017, Journal of Inclusion Phenomena and Macrocyclic Chemistry.

A Fluorescent 1,5-Naphthalenedisulfonate Anion-Linked Cucurbit[6]uril Framework

C. Hao, Li Liu, Yuhang Yao, 2015 .

Cobalt-Pyrazolate-Derived N-Doped Porous Carbon with Embedded Cobalt Oxides for Enhanced Oxygen Evolution Reaction

Xuedan Song, C. Hao, Weiwei Qiu, 2019, Electrocatalysis.

Simulation study of hydrogen storage in two kinds of Y-junction carbon nanotubes

Yongfeng Li, C. Hao, Hongli Wu, 2003, 2003 Third IEEE Conference on Nanotechnology, 2003. IEEE-NANO 2003..

Facile Synthesis of Heterostructured MoS2-MoO3 Nanosheets with Active Electrocatalytic Sites for High-Performance Lithium-Sulfur Batteries.

Fengxiang Zhang, Yongpeng Li, C. Hao, 2021, ACS nano.

Impact of electronically excited state hydrogen bonding on luminescent covalent organic framework: a TD-DFT investigation

Xuedan Song, C. Hao, Jianzhang Zhao, 2018, Molecular Physics.

Time-dependent density functional theory study of the excited-state dihydrogen bonding: clusters of 2-pyridone with diethylmethylsilane and triethylgermanium

Z. Xiu, C. Hao, Guang-Jin Zhao, 2011, Journal of molecular modeling.

Collision Time of A Triatomic Chemical Reaction A + BC

Keli Han, C. Hao, Yan Zhang, 2015 .

Micelle-template synthesis of a 3D porous FeNi alloy and nitrogen-codoped carbon material as a bifunctional oxygen electrocatalyst

Xuedan Song, Yantao Shi, C. Hao, 2020 .

P-doped Co9S8 nanoparticles embedded on 3D spongy carbon-sheets as electrochemical catalyst for lithium-sulfur batteries

Fengxiang Zhang, Yongpeng Li, C. Hao, 2021 .

Rational Construction of Atomically Dispersed Mn-Nx Embedded in Mesoporous N-Doped Amorphous Carbon for Efficient Oxygen Reduction Reaction in Zn-Air Batteries

C. Hao, Xin Wang, Guang-Lan Li, 2021, ACS Sustainable Chemistry & Engineering.

Microstructure evolution of Cu-TiC composites with the change of Ti/C ratio

H. Ding, C. Hao, T. Ci, 2019, Results in Physics.

Improved OER performance of Co3O4/N-CNTs derived from newly designed ZIF-67/PPy NTs composite

Xuedan Song, C. Hao, Weiwei Qiu, 2020 .

Elucidating photolysis mechanisms of ketamine by quantum chemical calculations

C. Hao, Yifan Shen, Shuwen Wang, 2022, Computational and Theoretical Chemistry.

Reply to Comment on “Important role of reaction field in photodegradation of deca-bromodiphenyl ether: Theoretical and experimental investigations of solvent effects” [Chemosphere 76(11) (2009) 1486–1490]

C. Hao, Jingwen Chen, Hongxia Zhao, 2010 .

Theoretical investigations on direct photolysis mechanisms of polychlorinated diphenyl ethers.

C. Hao, Jingwen Chen, Zhanxian Gao, 2014, Chemosphere.

Theoretical investigation on photodechlorination mechanism of polychlorinated biphenyls.

C. Hao, Jingwen Chen, Zhanxian Gao, 2014, Chemosphere.

Protein flexibility and conformational states of Leishmania antigen eIF-4A: identification of a novel plausible protein adjuvant using comparative genomics and molecular modeling

A. Hamza, C. Zhan, Z. Xiu, 2013, Journal of biomolecular structure & dynamics.

Selective Insertion in Copolymerization of Ethylene and Styrene Catalyzed by Half-Titanocene System Bearing Ketimide Ligand: A Theoretical Study

G. He, C. Hao, Xiaowei Xu, 2017 .

Combined experimental and theoretical study on photoinduced toxicity of an anthraquinone dye intermediate to Daphnia magna

C. Hao, Jingwen Chen, Zhen Wang, 2009, Environmental toxicology and chemistry.

Reaction mechanism for methanol oxidation on Au(1 1 1): A density functional theory study

C. Hao, Donghui Zhang, Shuping Liu, 2013 .

Adsorption and inhibitive properties of Apigenin derivatives as eco-friendly corrosion inhibitors for brass in nitric acid solution

C. Hao, Huilong Wang, Wen-Feng Jiang, 2019, Journal of Adhesion Science and Technology.

Effects of microstructural functional polyaniline layers on SPEEK/HPW proton exchange membranes

C. Hao, Suzhen Ren, Ying Yang, 2014 .

Development of simulation approach for two-dimensional chiral molecular self-assembly driven by hydrogen bond at the liquid/solid interface

L. Wan, Yuanhang Qin, C. Hao, 2017 .

A 3D Covalent Organic Framework with Exceptionally High Iodine Capture Capability.

Xinwen Guo, Xuedan Song, C. Hao, 2018, Chemistry.

A quantum-mechanical study on the complexation of β-cyclodextrin with quercetin

Z. Xiu, Chunli Yan, C. Hao, 2006 .

Time‐dependent density functional theory study on the electronic excited‐state hydrogen‐bonding dynamics of 4‐aminophthalimide (4AP) in aqueous solution: 4AP and 4AP–(H2O)1,2 clusters

Peng Li, Rui Wang, Jingwen Chen, 2010, J. Comput. Chem..

Molecular modeling study of beta-cyclodextrin complexes with (+)-catechin and (-)-epicatechin.

Zhilong Xiu, Ce Hao, Z. Xiu, 2007, Journal of molecular graphics & modelling.

Theoretical study for quercetin/β-cyclodextrin complexes: quantum chemical calculations based on the PM3 and ONIOM2 method

Z. Xiu, Chunli Yan, Hu Teng, 2007 .

Transition metal selenides as efficient counter-electrode materials for dye-sensitized solar cells.

T. Ma, Yantao Shi, C. Hao, 2015, Physical chemistry chemical physics : PCCP.

Computational insights into the mechanism of formaldehyde detection by luminescent covalent organic framework

Xuedan Song, Yantao Shi, C. Hao, 2019, Journal of Molecular Modeling.

A relativistic density functional study of gaseous uranium tetrahalides

C. Hao, Yude Li, Yunguang Zhang, 2008 .

Infrared spectra of neutral dimethylamine clusters: An infrared-vacuum ultraviolet spectroscopic and anharmonic vibrational calculation study.

J. Kuo, Xueming Yang, C. Hao, 2019, The Journal of chemical physics.

A quantum-mechanical study on the geometry of a hexacyclopeptide dichotomin A

Z. Xiu, Chunli Yan, Hu Teng, 2007 .

Enhancing lithium–sulphur battery performance by strongly binding the discharge products on amino-functionalized reduced graphene oxide

X. Lou, Zhiyu Wang, Zongbin Zhao, 2014, Nature Communications.

Combined Spectroscopic and Theoretical Approach to Sulfur-Poisoning on Cu-Supported Ti-Zr Mixed Oxide Catalyst in the Selective Catalytic Reduction of NOx

M. Tadé, Shaobin Wang, Xinyong Li, 2014 .

Ionic liquid-assisted pickering emulsion synthesis of hierarchical porous carbon wrapped graphene nanosheets for high performance lithium-sulfur batteries

C. Hao, Yang Yan, Nan Cui, 2019, Journal of Alloys and Compounds.

The microstructures and properties of in-situ ZrB2 reinforced Cu matrix composites

H. Ding, C. Hao, Xiaoliang Fan, 2019, Results in Physics.

3D flower-like polypyrrole-derived N-doped porous carbon coupled cobalt oxide as efficient oxygen evolution electrocatalyst

C. Hao, Weiwei Qiu, Jialin Zhao, 2020 .

Insight into the mechanism of selective catalytic reduction of NO(x) by propene over the Cu/Ti(0.7)Zr(0.3)O2 catalyst by Fourier transform infrared spectroscopy and density functional theory calculations.

Xinyong Li, Dongke Zhang, Qidong Zhao, 2013, Environmental science & technology.

A unified intermediate and mechanism for soot combustion on potassium-supported oxides

Lirong Zheng, Ying Xin, Qian Li, 2014, Scientific Reports.

Photophysical and photochemical insights into the photodegradation of sulfapyridine in water: A joint experimental and theoretical study.

Xiaoxuan Wei, Zhongfang Chen, Xuedan Song, 2018, Chemosphere.

Time-dependent density functional theory study on the coexistent intermolecular hydrogen-bonding and dihydrogen-bonding of the phenol-H2O-diethylmethylsilane complex in electronic excited states.

Z. Xiu, C. Hao, Ning-Ning Wei, 2010, Physical chemistry chemical physics : PCCP.

New Insights into the Anchoring Mechanism of Polysulfides inside Nanoporous Covalent Organic Frameworks for Lithium-Sulfur Batteries.

Xuedan Song, C. Hao, M. Yao, 2018, ACS applied materials & interfaces.

An insight into the reaction mechanism of CO2 photoreduction catalyzed by atomically dispersed Fe atoms supported on graphitic carbon nitride.

Wei Liu, Xuedan Song, Yantao Shi, 2021, Physical chemistry chemical physics : PCCP.

Mechanism of the collision energy and reagent vibration's effects on the collision time for the reaction Ca + HCl

Keli Han, C. Hao, Yan Zhang, 2015 .

Infrared-Vacuum Ultraviolet Spectroscopic and Theoretical Study of Neutral Methylamine Dimer.

Dong Yang, Zhi-Jian Zhao, Xueming Yang, 2017, The journal of physical chemistry. A.

Infrared-Vacuum Ultraviolet Spectroscopic and Theoretical Study of Neutral Trimethylamine Dimer

Zhi-Jian Zhao, Xueming Yang, C. Hao, 2017 .

Calixarene building block bis(2-hydroxyphenyl)methane (2HDPM) and hydrogen-bonded 2HDPM-H2O complex in electronic excited state

C. Hao, Jingwen Chen, Zhanxian Gao, 2013, Journal of Molecular Modeling.

Hormone Activity of Hydroxylated Polybrominated Diphenyl Ethers on Human Thyroid Receptor-β: In Vitro and In Silico Investigations

Na Li, Ce Hao, Ping Chi, 2009, Environmental health perspectives.

Fluorescence quenching mechanism of 9-hydroxyphenal-1-one carbon quantum dots by Cu2+ ions: An experimental and computational investigation

Xuedan Song, C. Hao, Zhengyan Zhao, 2020 .

Tuned single atom coordination structures mediated by polarization force and sulfur anions for photovoltaics

Wei Liu, Danyang Wu, Yantao Shi, 2021, Nano Research.

Atomic-level structure engineering of Ni-substituted Ni Co3−S4 for enhancing performance of supercapacitors

Xuedan Song, C. Hao, Weiwei Qiu, 2019, Journal of Electroanalytical Chemistry.

In-situ liquid cell transmission electron microscopy investigation on oriented attachment of gold nanoparticles

K. Yin, Litao Sun, J. Liu, 2018, Nature Communications.

Comparative molecular dynamics simulations of histone deacetylase‐like protein: Binding modes and free energy analysis to hydroxamic acid inhibitors

Z. Xiu, Chunli Yan, Hu Teng, 2008, Proteins.

Drug-resistant molecular mechanism of CRF01_AE HIV-1 protease due to V82F mutation

Xiaoqing Liu, Zhilong Xiu, Ce Hao, 2009, J. Comput. Aided Mol. Des..

Proton delivery through a dynamic 3D H-bond network constructed from dense hydroxyls for advanced ion-selective membranes

Wenji Zheng, Yan Dai, G. He, 2019, Journal of Materials Chemistry A.

Hollow Tin Dioxide Microspheres With Multilayered Nanocrystalline Shells for Pseudocapacitor

C. Hao, Suzhen Ren, Ying Yang, 2015 .

Quantum chemical investigation on photodegradation mechanisms of sulfamethoxypyridazine with dissolved inorganic matter and hydroxyl radical.

C. Hao, S. Shah, 2017, Journal of environmental sciences.

Quantum chemical study of the photolysis mechanisms of sulfachloropyridazine and the influence of selected divalent metal ions.

Xuedan Song, C. Hao, S. Shah, 2015, Chemosphere.

Microscopic modes and free energies for topoisomerase I-DNA covalent complex binding with non-camptothecin inhibitors by molecular docking and dynamics simulations

A. Hamza, C. Zhan, Z. Xiu, 2013, Theoretical Chemistry Accounts.

The Interaction between Graphene and Oxygen Atom

Xuedan Song, C. Hao, Xiaobing Zhu, 2016 .

Excited-state hydrogen bonding: Detecting ammonia using an HHTP-DPB covalent organic framework

Xuedan Song, C. Hao, P. Han, 2020 .

Insight into the CO2 photoreduction mechanism over 9-hydroxyphenal-1-one (HPHN) carbon quantum dots

Xuedan Song, Yantao Shi, C. Hao, 2020 .

TDDFT investigation on the solvent effect of methanol on the electronic structure and luminescence of metal organic framework CdL2

C. Hao, Yao Fu, Tianyu Deng, 2019, Chemical Physics.

A recognition mechanism study: Luminescent metal-organic framework for the detection of nitro-explosives.

Xuedan Song, C. Hao, Lei Liu, 2018, Journal of molecular graphics & modelling.

Effect of CH3OH on the luminescent properties of the [Zn(sfdb)(bpy)(H2O)]n · 0.5nCH3OH metal–organic framework

Xuedan Song, Yantao Shi, C. Hao, 2015 .

Polyaniline-based electrocatalysts through emulsion polymerization: Electrochemical and electrocatalytic performances

Shehnaz, Xuedan Song, C. Hao, 2017 .

Design Principles for Covalent Organic Frameworks to Achieve Strong Heteroatom-Synergistic Effect on Anchoring Polysulfides for Lithium-Sulfur Batteries.

Xuedan Song, C. Hao, M. Yao, 2019, The journal of physical chemistry letters.

A density functional theory/time-dependent density functional theory study of the structure-related photochemical properties of hydroxylated polybrominated diphenyl ethers and methoxylated polybrominated diphenyl ethers and metal ion effects

Longyan Li, C. Hao, S. Shah, 2020, Environmental Science and Pollution Research.

Carbon-based Single Atom Catalysts for Tailoring ORR Pathway: A Concise Review

Wei Liu, Yantao Shi, C. Hao, 2021, Journal of Materials Chemistry A.

The Adsorption, Vibration and Diffusion of Hydrogen Atoms on Platinum Low-Index Surfaces

C. Hao, Ze-xin Wang, Yanjie Yu, 2009 .

Insight into the Inhibition of Shuttle by Metal-Modified Covalent Triazine Frameworks and Graphene Composites with the Solvent Interaction in Lithium Sulfur Batteries

C. Hao, J. Qiu, Fengyi Zhou, 2022, ACS Applied Energy Materials.

Insights into the Anchoring of Polysulfides and Catalytic Performance by Metal Phthalocyanine Covalent Organic Frameworks as the Cathode in Lithium–Sulfur Batteries

Xuedan Song, C. Hao, M. Yao, 2020 .

Channel-wall functionalization in covalent organic frameworks for the enhancement of CO2 uptake and CO2/N2 selectivity

Xinwen Guo, Xuedan Song, C. Hao, 2016 .

Atomic Evolution of Metal–Organic Frameworks into Co–N3 Coupling Vacancies by Cooperative Cascade Protection Strategy for Promoting Triiodide Reduction

Dingsheng Wang, Wei Liu, Yantao Shi, 2021 .

Experimental and theoretical studies on the photoinduced acute toxicity of a series of anthraquinone derivatives towards the water flea (Daphnia magna)

Liping Huang, C. Hao, Jingwen Chen, 2009 .

Modeling photoinduced toxicity of PAHs based on DFT-calculated descriptors.

Fei Li, C. Hao, Jingwen Chen, 2009, Chemosphere.

Biomass-Derived Multilayer-Graphene-Encapsulated Cobalt Nanoparticles as Efficient Electrocatalyst for Versatile Renewable Energy Applications

Danyang Wu, Xuedan Song, Yantao Shi, 2018, ACS Sustainable Chemistry & Engineering.

Electrocatalytic properties of iron chalcogenides as low-cost counter electrode materials for dye-sensitized solar cells

T. Ma, Yantao Shi, C. Hao, 2015 .

Multiple active components synergistically driven heteroatom-doped porous carbon as high-performance counter electrode in dye-sensitized solar cells

Danyang Wu, Xuedan Song, Yantao Shi, 2019, Journal of Energy Chemistry.

Elucidating triplet-sensitized photolysis mechanisms of sulfadiazine and metal ions effects by quantum chemical calculations.

Xuedan Song, C. Hao, Jingwen Chen, 2015, Chemosphere.

Ionothermal Synthesis of Graphene-Based Hierarchically Porous Carbon for High-Energy Supercapacitors with Ionic Liquid Electrolyte

C. Hao, Yang Yan, Xiao-Feng Hao, 2017 .

Hydrothermal synthesis of Fe2O3/polypyrrole/graphene oxide composites as highly efficient electrocatalysts for oxygen reduction reaction in alkaline electrolyte

C. Hao, Q. Mao, Suzhen Ren, 2015 .

Boosting oxygen-reduction catalysis over mononuclear CuN2+2 moiety for rechargeable Zn-air battery

Y. Lei, Wei Liu, Yantao Shi, 2022 .

In-situ coating N, S-codoped porous carbon thin film on carbon nanotubes as an advanced metal-free bifunctional oxygen electrocatalyst for Zn-air batteries

Suli Wang, G. Sun, C. Hao, 2021, Catalysis Science & Technology.

Nitrogen-doped Porous Carbon Networks with Active Fe-Nx Sites to Enhance Catalytic Conversion of Polysulfides in Lithium-Sulfur Batteries.

Fengxiang Zhang, Yongpeng Li, C. Hao, 2019, ACS applied materials & interfaces.

Rational design and fabrication of sulfur-doped porous graphene with enhanced performance as a counter electrode in dye-sensitized solar cells

Chang Yu, B. Lu, Xuedan Song, 2017 .

Nitrogen‐Doped Graphene Nanoribbons with Surface Enriched Active Sites and Enhanced Performance for Dye‐Sensitized Solar Cells

Chang Yu, Yang Liu, Xuedan Song, 2015 .

Ionic Liquid‐Assisted Preparation of Sb2S3/Reduced Graphene Oxide Nanocomposite for Sodium‐Ion Batteries

C. Hao, Yang Yan, Nan Cui, 2018 .

Bromine Doping as an Efficient Strategy to Reduce the Interfacial Defects in Hybrid Two-Dimensional/Three-Dimensional Stacking Perovskite Solar Cells.

Xuedan Song, Yantao Shi, C. Hao, 2018, ACS applied materials & interfaces.

Defect-rich and metal-free N, S co-doped 3D interconnected mesoporous carbon material as an advanced electrocatalyst towards oxygen reduction reaction

Suli Wang, G. Sun, C. Hao, 2021 .

Time-dependent density functional theory study on the electronic excited-state hydrogen bonding of the chromophore coumarin 153 in a room-temperature ionic liquid

C. Hao, J. Qiu, S. Wang, 2012, Journal of Molecular Modeling.

The interaction between C70 (D5h) and X atom (X = H, F)

C. Hao, Shaopeng Sun, Jinlan Sun, 2009 .

NC unit trapped by fullerenes: a density functional theory study on Sc3NC@C(2n) (2n = 68, 78 and 80).

Zhongfang Chen, C. Hao, Peng Jin, 2010, Physical chemistry chemical physics : PCCP.

Reaction mechanism for CO oxidation on Cu(3 1 1): A density functional theory study

C. Hao, Donghui Zhang, Shuping Liu, 2012 .

Time-dependent density functional theory study of the excited-state dihydrogen bond O–H⋯H–Si

Zhilong Xiu, Peng Li, Ning-Ning Wei, 2010 .

The interaction between oxygen atom and C36 (D6h)

C. Hao, Shenmin Li, Ying-fu Jin, 2008 .

Benzimidazolium functionalized polysulfone-based anion exchange membranes with improved alkaline stability

G. He, C. Hao, Xiaoming Yan, 2017, Chinese Journal of Polymer Science.

Time-dependent density functional theory study on electronic excited states of the hydrogen-bonded solute–solvent phenol–(H2O)n (n=3–5) clusters

C. Hao, Jingwen Chen, Zhanxian Gao, 2011 .

Hydrogen Bonding Dynamics of Phenol-(H 2 O) 2 Cluster in the Electronic Excited State: a DFT/TDDFT Study

C. Hao, J. Qiu, S. Wang, 2011 .

The oxygen sensing mechanism of a trifluoromethyl-substituted cyclometalated platinum(II) complex

Xuedan Song, C. Hao, Tianqing Liu, 2018, Computational and Theoretical Chemistry.

ELECTRON TRANSFER MAKES D3h (78:5) CAGE EASY TO FORM M2@C78(M = La, Ce): A RELATIVISTIC DENSITY-FUNCTIONAL THEORY STUDY

C. Hao, Hongjiang Li, J. Qiu, 2012 .

Dynamic motion of an Lu pair inside a C76(Td) cage

Zhongfang Chen, C. Hao, Fengyu Li, 2015 .

NC unit trapped by fullerenes: a density functional theory study on Sc3NC@C(2n) (2n = 68, 78 and 80).

Zhongfang Chen, C. Hao, Peng Jin, 2010, Physical chemistry chemical physics : PCCP.

A DFT/TDDFT study on the mechanisms of direct and indirect photodegradation of tetrabromobisphenol A in water.

C. Hao, W. Peijnenburg, Zhuang Wang, 2019, Chemosphere.

Which configuration is more stable for La2@C80, D3d or D2h? Recomputation with ZORA methods within ADF

Junfeng Zhang, C. Hao, Shenmin Li, 2007 .

Time-dependent density functional theory study on the hydrogen bonding in electronic excited states of 6-amino-3-((thiophen-2-yl) methylene)-phthalide in methanol solution

C. Hao, Jingwen Chen, J. Qiu, 2011 .

Study of the mechanisms of dialkyl carbonates directly formed from carbon dioxide and alcohols: New insights from kinetic and thermodynamic processes

Xuedan Song, Yantao Shi, C. Hao, 2020 .

Photodegradation fate of different dissociation species of antidepressant paroxetine and the effects of metal ion Mg2+: Theoretical basis for direct and indirect photolysis.

C. Hao, Yifan Shen, S. Wang, 2023, Chemosphere.

Experimental investigation and theoretical exploration of single-atom electrocatalysis in hybrid photovoltaics: The powerful role of Pt atoms in triiodide reduction

Tao Zhang, Xuedan Song, Yantao Shi, 2017 .

A time-dependent density functional theory study on the effect of electronic excited-state hydrogen bonding on luminescent MOFs.

C. Hao, M. Ji, Hongjiang Li, 2013, Dalton transactions.

Electron-accepting potential of solvents determines photolysis rates of polycyclic aromatic hydrocarbons: experimental and density functional theory study.

C. Hao, Jingwen Chen, Xuehua Li, 2010, Journal of hazardous materials.

Theoretical study on the motion of a La atom inside a C82 cage.

Junfeng Zhang, C. Hao, Q. Hou, 2007, The journal of physical chemistry. A.

Tea-leaf-residual derived electrocatalyst: Hierarchical pore structure and self nitrogen and fluorine co-doping for efficient oxygen reduction reaction

Danyang Wu, Xuedan Song, Yantao Shi, 2018, International Journal of Hydrogen Energy.

The effect of furcated hydrogen bond and coordination bond on luminescent behavior of metal-organic framework [CuCN·EIN]: a TDDFT study.

Danyang Wu, C. Hao, M. Ji, 2012, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Theoretical study of triiodide reduction reaction on nitrogen-doped graphene for dye-sensitized solar cells

C. Hao, Juanyuan Hao, Yuyan Zhang, 2016, Theoretical Chemistry Accounts.

New insight into the ultra-long lifetime of excitons in organic–inorganic perovskite: Reverse intersystem crossing

Shufeng Wang, Yantao Shi, C. Hao, 2017, Journal of Energy Chemistry.

Elucidating photodehalogenation mechanisms of polychlorinated and polybrominated dibenzo-p-dioxins and dibenzofurans and Mg2+ effects by quantum chemical calculations

Xuedan Song, C. Hao, Jingwen Chen, 2014 .

Exploration of the basic reactant in CO2 photoreduction: New insights from photophysics and photochemistry

Xuedan Song, Yantao Shi, C. Hao, 2019, Journal of Photochemistry and Photobiology A: Chemistry.

Photophysical and photochemical insights of the photodegradation of norfloxacin: The rate-limiting step and the influence of Ca2+ ion.

Xuedan Song, Jianhui Liu, C. Hao, 2019, Chemosphere.

Ozonization, Amination and Photoreduction of Graphene Oxide for Triiodide Reduction Reaction: An Experimental and Theoretical Study

Xuedan Song, Yantao Shi, C. Hao, 2017 .

Molecular dynamics study of hydrogen adsorption in Y-junction carbon nanotubes

C. Hao, Hongli Wu, J. Qiu, 2004 .

Isobaric vapor–liquid equilibrium of tert ‐butanol + water + ionic liquids at atmospheric pressure

C. Hao, Zongchang Zhao, Xiao-Dang Zhang, 2020 .

Effective construction of a B and N co-doped 3D porous carbon metal-free oxygen reduction reaction catalyst by a secondary pyrolysis strategy

Suli Wang, C. Hao, Xin Wang, 2023, Catalysis Science & Technology.

Collision time of a triatomic chemical reactio nA+B C Xiaohu He, Victor Wei-Keh Chao (Wu), Keli Han, Ce Hao, and Yan Zhang

C. Hao, Yan Zhang, Y. Zhang, 2015 .

A novel and efficient ligand-based virtual screening approach using the HWZ scoring function and an enhanced shape-density model

A. Hamza, C. Zhan, Z. Xiu, 2013, Journal of biomolecular structure & dynamics.

New insights into the nitroaromatics-detection mechanism of the luminescent metal-organic framework sensor.

C. Hao, Xiaofang Chen, Lei Liu, 2015, Dalton transactions.

A 3D Covalent Organic Framework with Exceptionally High Iodine Capture Capability.

Xinwen Guo, Xuedan Song, C. Hao, 2018, Chemistry.

Synthesis, isolation, spectroscopic and electrochemical characterization of some calcium-containing metallofullerenes

Z. Gu, Zujin Shi, C. Hao, 2006 .

Important role of reaction field in photodegradation of deca-bromodiphenyl ether: theoretical and experimental investigations of solvent effects.

C. Hao, Jingwen Chen, Hongxia Zhao, 2009, Chemosphere.

DFT/TDDFT insights into effects of dissociation and metal complexation on photochemical behavior of enrofloxacin in water

C. Hao, W. Peijnenburg, Zhuang Wang, 2018, Environmental Science and Pollution Research.

A relativistic DFT study on the structure and property of M(M = Ba, Sr) @ C74 (D3h)

C. Hao, Suzhen Ren, D. Tian, 2013 .

A novel and efficient ligand-based virtual screening approach using the HWZ scoring function and an enhanced shape-density model

Zhilong Xiu, Chang-Guo Zhan, Adel Hamza, 2013, Journal of biomolecular structure & dynamics.

Bromine Doping as an Efficient Strategy to Reduce the Interfacial Defects in Hybrid Two-Dimensional/Three-Dimensional Stacking Perovskite Solar Cells.

Xuedan Song, Yantao Shi, C. Hao, 2018, ACS applied materials & interfaces.

Computational Study of Photodegradation Process and Conversion Products of the Antidepressant Citalopram in Water

C. Hao, Yifan Shen, Kai Chen, 2023, Molecules.