Jian-Bo Cheng

发表

Monolayer Ti₂CO₂: A Promising Candidate for NH₃ Sensor or Capturer with High Sensitivity and Selectivity.

Qingzhong Li, Xue-fang Yu, Xin Yang, 2015, ACS applied materials & interfaces.

Surface oxygen vacancies of Pd/Bi2MoO6-x acts as “Electron Bridge” to promote photocatalytic selective oxidation of alcohol

Jianqiang Yu, Xiaolong Yang, Kaisheng Zhang, 2021 .

Multiple weak interaction‐assisted SERS detection platform for triadimefon

Weidong Ruan, Wei Song, Bing Zhao, 2015 .

Carbon Excess C3N: A Potential Candidate as Li-Ion Battery Material.

Qingzhong Li, Wenzuo Li, Xue-fang Yu, 2018, ACS applied materials & interfaces.

Visible-near-infrared-responsive g-C3N4Hx+ reduced decatungstate with excellent performance for photocatalytic removal of petroleum hydrocarbon.

Jianqiang Yu, J. Yu, Xiaolong Yang, 2020, Journal of hazardous materials.

Protic vs Aprotic Solvent Effect on Proton Transfer in 3-Hydroxyisoquinoline: A Theoretical Study.

Xue-fang Yu, B. Xiao, Yan-chun Li, 2015, The journal of physical chemistry. A.

Non-additivity between substitution and cooperative effects in enhancing hydrogen bonds.

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2014, The Journal of chemical physics.

Mutual influence between covalent and noncovalent interactions in H3N–MCN–XF (X = H, Li, Cl, Br; M = Ag, Cu, Au)

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2014 .

Cooperative and diminutive effects of pnicogen bonds and cation-π interactions.

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2014, Chemphyschem : a European journal of chemical physics and physical chemistry.

Competition and cooperativity between hydrogen bond and halogen bond in HNC⋯(HOBr)n and (HNC)n⋯HOBr (n = 1 and 2) systems

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2011 .

Theoretical study on the interlay of hydrogen bonds in the trimers involving HCN and water

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2009 .

Theoretical study on the cooperativity of hydrogen bonds in (HNC)2⋯HF complexes

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2009 .

Is a Hm−1X (X = O, S, Se, m = 1; X = N, m = 2; X = C, m = 3) radical a better proton donor than HmX–H in hydrogen bonding?

Qingzhong Li, Wenzuo Li, Huizhi Kou, 2011 .

A theoretical analysis of the weakly bound complexes HM ··· HXY (M=O and S; XY=CN and NC): comparison with H2M ··· HXY complexes

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2010 .

Symmetry-adapted perturbation theory interaction energy decomposition for H2CY-XF (Y = O, S, Se; X = H, Li, Cl) complex

Qingfu Ban, Qingzhong Li, Jian-Bo Cheng, 2012 .

Interplay between the σ-tetrel bond and σ-halogen bond in PhSiF3⋯4-iodopyridine⋯N-base

Qingzhong Li, Zhenbo Liu, Hui-Li Xu, 2017 .

Effect of superalkali substituents on the strengths and properties of hydrogen and halogen bonds

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013, Journal of Molecular Modeling.

Cooperativity between the halogen bond and the hydrogen bond in H3N...XY...HF complexes (X, Y=F, Cl, Br).

Qingquan Lin, Qingzhong Li, Jian-Bo Cheng, 2008, Chemphyschem : a European journal of chemical physics and physical chemistry.

Is there an attractive interaction between two methyl groups

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2014 .

Negative Photoconductance Effect: An Extension Function of the TiOx‐Based Memristor

Shukai Duan, Lidan Wang, Cunyun Xu, 2021, Advanced Science.

Ab initio study of synergetic effects of two strong interactions of cation–π interaction and lithium bond in M+ ··· phenyl lithium ··· N (M = Li, Na, K; N = H2O and NH3) complex

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012 .

Tetrel Bond between 6-OTX3-Fulvene and NH3: Substituents and Aromaticity

Haibei Li, Shufeng Liu, Qingzhong Li, 2018, Molecules.

Prediction and characterization of halogen bonds involving formamidine and its derivatives.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2015, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Atomic Insight into the Origin of Various Operation Voltages of Cation-Based Resistance Switches.

Xue-fang Yu, B. Xiao, Jian-Bo Cheng, 2016, ACS applied materials & interfaces.

Vibrational spectroscopy and density functional theory study of 4-mercaptobenzoic acid.

Bing Zhao, Lei Chen, Jian-Bo Cheng, 2015, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Cobalt(II)‐Catalyzed Bisfunctionalization of Alkenes with Diarylphosphine Oxide and Peroxide

Shangdong Yang, Jian-Bo Cheng, Jinchun Chen, 2019, Advanced Synthesis & Catalysis.

Sensing mechanism of HBT based F anion fluorescence sensor: A theoretical study

Qingzhong Li, Jian-Bo Cheng, Xue-fang Yu, 2019, Sensors and Actuators B: Chemical.

Tetrel bonds between PhSiF3 /PhTH3 (T = Si, Ge, Sn) and H3 ZO (Z = N, P, As): A pentacoordinate silicon (IV) complex

Haibei Li, Qingzhong Li, Jian-Bo Cheng, 2018, International Journal of Quantum Chemistry.

MXenes: Reusable materials for NH3 sensor or capturer by controlling the charge injection

Jianbo Cheng, Yan-Chun Li, Xue-fang Yu, 2016 .

Ti3C2Tx with a hydroxyl-rich surface for metal sulfides as high performance electrode materials for sodium/lithium storage

Jian Yang, Xueqin Sun, Fuyi Jiang, 2021 .

Studies on the structure and miscibility of mixed Langmuir-Blodgett films of a double-armed dibenzo-18-crown-6 ether with stearic acid.

Yuchuan Cheng, Wei Song, Bing Zhao, 2007, Journal of colloid and interface science.

Penta-graphene: A Promising Anode Material as the Li/Na-Ion Battery with Both Extremely High Theoretical Capacity and Fast Charge/Discharge Rate.

Yan-Chun Li, Xue-fang Yu, B. Xiao, 2016, ACS applied materials & interfaces.

Screening NIR fluorescent sensor based on HBQ derivatives: A theoretical study

Qingzhong Li, Zhenbo Liu, Xin Yang, 2019, Journal of Photochemistry and Photobiology A: Chemistry.

Photophysical properties and excited state proton transfer in 1,8-Dihydroxydibenzo[a,h]phenazine: A theoretical study

Qingzhong Li, Xue-fang Yu, B. Xiao, 2018 .

Double-proton transfer mechanism in 1,8-dihydroxydibenzo[a,c]phenazine: a TDDFT and ab initio study

Xue-fang Yu, B. Xiao, Jian-Bo Cheng, 2015, Theoretical Chemistry Accounts.

Ab initio study of the cooperativity between NH···N and NH···C hydrogen bonds in H3N–HNC–HNC complex

Qingchuan Zheng, Qingzhong Li, Jian-Bo Cheng, 2010 .

Push-pull electron effects of the complexant in a Li atom doped molecule with electride character: a new strategy to enhance the first hyperpolarizability.

Y. Li, Chia-Chung Sun, Zong‐Jun Li, 2010, Physical chemistry chemical physics : PCCP.

Stitching Electron Localized Heptazine Units with “Carbon Patches” to Regulate Exciton Dissociation Behavior of Carbon Nitride for Photocatalytic Elimination of Petroleum Hydrocarbons

Qi Guo, Jian-Bo Cheng, Kaisheng Zhang, 2022, SSRN Electronic Journal.

CH4 activation by PtX+ (X = F, Cl, Br, I)

Shaoli Liu, Qingzhong Li, Jian-Bo Cheng, 2022, Frontiers in Chemistry.

Influence of F and Se substitution on the structures, stabilities and nature of the complexes between F2CSe and HOX (X = F, Cl, Br, and I)

Qingzhong Li, Jian-Bo Cheng, Xin Yang, 2015 .

Cooperativity between OH...O and CH...O hydrogen bonds involving dimethyl sulfoxide-H2O-H2O complex.

Qingzhong Li, Jian-Bo Cheng, Xiulin An, 2007, The journal of physical chemistry. A.

Is a MH (M = Be and Mg) radical a better electron donor in halogen‐hydride interaction?: A theoretical comparison with HMH

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013 .

Prediction and characterization of a chalcogen-hydride interaction with metal hybrids as an electron donor in F2CS-HM and F2CSe-HM (M = Li, Na, BeH, MgH, MgCH3) complexes.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012, Physical chemistry chemical physics : PCCP.

Prediction of the maximum absorption wavelength of azobenzene dyes by QSPR tools.

Feng Luan, Xiaoyun Zhang, Jianbo Cheng, 2011, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Vibrational spectroscopy and density functional theory study of ninhydrin.

Bing Zhao, Lei Chen, Jian-Bo Cheng, 2015, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Vibrational spectroscopy and density functional theory study of 4-mercaptophenol.

Bing Zhao, Lei Chen, Wei Ji, 2014, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Density functional theory calculation of vibrational spectroscopy of trans-1,2-bis(4-pyridyl)-ethylene

Wei Zhao, Bing Zhao, Gang Zhang, 2007 .

Superalkali Li3M (M = Cl, Br, I) as a Lewis base in halogen bonding: A heavier halogen is a stronger Lewis base than a lighter halogen

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013 .

Rare gas atomic number dependence of the halogen bond in HRgF–XCCF (Rg = He, Ar, Kr; X = Cl, Br) complex

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2011 .

A BODIPY‐Diaminomaleonitrile Based Water‐Soluble Fluorescent Probe for Selective “Off‐On” Detection of Hypochlorite**

Lijuan Yuan, Zhenbo Liu, Shuang Liu, 2022, ChemistrySelect.

Novel non-covalent interactions involved with the Al13M cluster (M = Li, Na, K, Cu, Ag, Au)

Qingzhong Li, Hongying Zhuo, Wenzuo Li, 2014 .

A new interaction mechanism of LiNH2 with MgH2: magnesium bond

Qingzhong Li, Jian-Bo Cheng, Xin Yang, 2012, Journal of Molecular Modeling.

The aerogen–π bonds involving π systems

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2016 .

Effect of methyl group on the cooperativity of CH···O blue-shifted hydrogen bond in HCHO-HCHO-HCHO cyclic complex

Qingzhong Li, Haiping Liu, B. Gong, 2008 .

Prediction and characterization of HCCH···AuX (X = OH, F, Cl, Br, CH3, CCH, CN, and NC) complexes: a π Au-bond.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2011, The Journal of chemical physics.

Some measures for mediating the strengths of halogen bonds with the B–B bond in diborane(4) as an unconventional halogen acceptor

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2014 .

Influence of substituents and cooperativity in doubly hydrogen-bonded complexes of 2-pyridone and oxalic acid

Shubin Yang, Qingzhong Li, Yuanxin Wei, 2018 .

Halogen bonds with N-heterocyclic carbenes as halogen acceptors: a partially covalent character

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2014 .

Concerted interaction between pnicogen and halogen bonds in XCl-FH2P-NH3 (X=F, OH, CN, NC, and FCC).

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012, Chemphyschem : a European journal of chemical physics and physical chemistry.

Pnicogen-hydride interaction between FH2X (X = P and As) and HM (M = ZnH, BeH, MgH, Li, and Na).

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012, The journal of physical chemistry. A.

Influence of cooperativity on the frequency shift of the Ar–H stretch vibration in HArF complexes

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013 .

Hydrogen bond and σ-hole interaction in M2C=S···HCN (M = H, F, Cl, Br, HO, H3C, H2N) complex: Dual roles of C=S group and substitution effect

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2012 .

Some measures for making halogen bonds stronger than hydrogen bonds in H2CS-HOX (X = F, Cl, and Br) complexes.

F. Luan, Qingzhong Li, Jian-Bo Cheng, 2011, Physical chemistry chemical physics : PCCP.

Large blue shift of the H-Ar stretching frequency in hydrogen- and halogen-bonded complexes of HArF with dihalogen molecules.

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2010, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Theoretical study of halogen–hydride halogen bonds in F3CL ··· HM (L=Cl, Br; M=Li, BeH, MgH) complexes

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2010 .

Theoretical study of lithium bond between XMgH (X = H, F, CH3) and LiCY3 (Y = H, F)

Jungang Yin, Qingzhong Li, Jian-Bo Cheng, 2009 .

Theoretical study of the interplay between lithium bond and hydrogen bond in complexes involved with HLi and HCN.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2009, Chemphyschem : a European journal of chemical physics and physical chemistry.

Prediction and characterization of the HMgHLiX (X = H, OH, F, CCH, CN, and NC) complexes: a lithium-hydride lithium bond.

Jianbo Cheng, Qingzhong Li, Yifang Wang, 2009, Physical chemistry chemical physics : PCCP.

Theoretical study on the π hydrogen-bonded complex between HArF and ethylene

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2009 .

Effect of methyl group on the cooperativity between cation–π interaction and NH···O hydrogen bonding

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2008 .

Cooperativity between the dihydrogen bond and the NHC hydrogen bond in LiH-(HCN)n Complexes.

Qingzhong Li, Jian-Bo Cheng, Xiulin An, 2008, Chemphyschem : a European journal of chemical physics and physical chemistry.

Spectroscopic and theoretical evidence for the cooperativity between red-shift hydrogen bond and blue-shift hydrogen bond in DMSO aqueous solutions.

Qingzhong Li, B. Gong, Jian-Bo Cheng, 2008, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

The structure, properties, and nature of unconventional π halogen bond in the complexes of Al42- and halohydrocarbons

Qingzhong Li, Wenzuo Li, Ran Li, 2012, Journal of Molecular Modeling.

Tetrel-hydride interaction between XH₃F (X = C, Si, Ge, Sn) and HM (M = Li, Na, BeH, MgH).

Haibei Li, Qingzhong Li, Jian-Bo Cheng, 2015, The journal of physical chemistry. A.

Theoretical study of halogen bonding between FnH3−nCBr (n = 0, 1, 2, 3) and HMgH

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2010 .

A new unconventional halogen bond CX···HM between HCCX (X = Cl and Br) and HMH (M = Be and Mg): An ab initio study

Xu Dong, Bo Jing, Jian-Bo Cheng, 2009, J. Comput. Chem..

How do organic gold compounds and organic halogen molecules interact? Comparison with hydrogen bonds

Haibei Li, Qingzhong Li, Wenzuo Li, 2015 .

Is π halogen bonding or lone pair···π interaction formed between borazine and some halogenated compounds?

Jianbo Cheng, Qingzhong Li, Qingzhong Li, 2014, Physical chemistry chemical physics : PCCP.

What is the role of defects in single-walled carbon nanotubes for nonlinear optical property?

Chia-Chung Sun, Zhongjun Zhou, Qingzhong Li, 2011 .

Interplay between metal⋅⋅⋅π interactions and hydrogen bonds: some unusual synergetic effects of coinage metals and substituents.

Qingzhong Li, Xin Yang, Wenzuo Li, 2013, Chemphyschem : a European journal of chemical physics and physical chemistry.

Gigantic blue shift of the H-Ar stretch vibration in pi hydrogen-bonded C(2)H(2)...HArCCF complex.

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2009, The journal of physical chemistry. A.

Superior Sodium Metal Anodes Enabled by Sodiophilic Carbonized Coconut Framework with 3D Tubular Structure

Jianchao Sun, Shizhe Gao, Zhenhua Yan, 2020, Advanced Energy Materials.

Dual function of the boron center of BH(CO)2/BH(N2)2 in halogen- and triel-bonded complexes with hypervalent halogens.

Qingzhong Li, Jian-Bo Cheng, Yanqing Wang, 2018, Journal of molecular graphics & modelling.

Carbene tetrel-bonded complexes

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2017, Structural Chemistry.

S···X halogen bonds and H···X hydrogen bonds in H2CS-XY (XY = FF, ClF, ClCl, BrF, BrCl, and BrBr) complexes: cooperativity and solvent effect.

Zhongjun Zhou, Qingzhong Li, Jian-Bo Cheng, 2012, The Journal of chemical physics.

Influence of substitution, hybridization, and solvent on the properties of C-HO single-electron hydrogen bond in CH3-H2O complex.

Qingzhong Li, Jian-Bo Cheng, Xiulin An, 2008, Journal of Physical Chemistry A.

Influence of hybridization and cooperativity on the properties of Au-bonding interaction: comparison with hydrogen bonds.

F. Luan, Qingzhong Li, Zhenbo Liu, 2011, The journal of physical chemistry. A.

Beryllium decorated armchair BC2N nanoribbons: coexistence of planar tetracoordinate carbon and nitrogen moieties

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2015 .

M2cs2 (M = Sc, Y) with Brand-New Mxene Phase: The Promising Candidate as the N/O-Containing Gases Sensor And/Or Capturer

Jian-Bo Cheng, Xue-fang Yu, B. Xiao, 2023, SSRN Electronic Journal.

The band gap modulation of monolayer Ti2CO2 by strain

Jianbo Cheng, Qingzhong Li, Zhenbo Liu, 2015 .

Abnormal Tetrel Bonds between Formamidine and TH3F: Substituent Effects

Qingzhong Li, Jian-Bo Cheng, Hui-Li Xu, 2018 .

Comparison for σ-hole and π-hole tetrel-bonded complexes involving F2CCFTF3 (TC, Si, and Ge): Substitution, hybridization, and solvation effects

Qingzhong Li, Jian-Bo Cheng, Wenbo Dong, 2018 .

Vibrational spectroscopy and density functional theory study of 3-[4,5-dimethyl-2-thiazolyl]-2,5-diphenyl-2H-tetrazolium bromide.

Bing Zhao, Lei Chen, Jian-Bo Cheng, 2015, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Ceric(IV) Ammonium Nitrate Mediated Phosphorylation of Alkenes: Easy Access to (E )-Vinylphosphonates

Jian-Bo Cheng, Yue Zhang, B. Xiao, 2019, European Journal of Organic Chemistry.

Comparison of σ-/π-Hole Tetrel Bonds between TH3 F/F2 TO and H2 CX (X=O, S, Se).

Shaoli Liu, Shufeng Liu, Qingzhong Li, 2019, Chemphyschem : a European journal of chemical physics and physical chemistry.

Triel-hydride triel bond between ZX3 (Z = B and Al; X = H and Me) and THMe3 (T = Si, Ge and Sn): Triel-hydride triel bond

Qingzhong Li, Jian-Bo Cheng, Jingru Zhang, 2018 .

Regulation of coin metal substituents and cooperativity on the strength and nature of tetrel bonds

Qingzhong Li, Yuanxin Wei, Wenzuo Li, 2017 .

Novel CX⋯π halogen bonds in complexes of acetylene and its derivatives of Na and MPH3 (M=Cu, Ag, Au) with XCCF (X=Cl, Br, I).

Qingzhong Li, Hongying Zhuo, Wenzuo Li, 2014, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

A σ-hole interaction with radical species as electron donors: does single-electron tetrel bonding exist?

Haibei Li, Qingzhong Li, Jian-Bo Cheng, 2014, Physical chemistry chemical physics : PCCP.

Modulating the strength of tetrel bonding through beryllium bonding

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2016, Journal of Molecular Modeling.

The insertion and H2 elimination reactions of H2GeFMgF germylenoid with RH (R = Cl, SH, PH2)

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2017, Russian Journal of Physical Chemistry A.

The addition reactions of germylenoid H2GeAlCl3 with ethylene: a theoretical investigation

Qingzhong Li, Wenzuo Li, Jian-Bo Cheng, 2017, Journal of Molecular Modeling.

Theoretical investigation of the addition reaction of the aluminum chlorosilylenoid H2SiAlCl3 with ethylene

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2016, Journal of Molecular Modeling.

Theoretical prediction on the addition reaction of germylenoid H2GeFMgF with ethylene

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2016 .

Theoretical prediction on the insertion reactions of the germylenoid H2GeLiF with GeH3X (X = F, Cl, Br)

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2015, Russian Journal of Physical Chemistry A.

A new exploration of the addition reaction of the silylenoid H2SiLiF with ethylene

Qingzhong Li, Wenzuo Li, Ming-Xia Zhang, 2015, Journal of Molecular Modeling.

Theoretical prediction on H2 elimination reactions of H2GeLiF with RH (R = Cl, SH, and PH2)

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2015, Russian Journal of Physical Chemistry A.

Structure of H2GeFMgF and its insertion reactions with RH (R = F, OH, NH2)

Qingzhong Li, Wenzuo Li, Ming-Xia Zhang, 2015 .

Substitution reactions of H2GeFBeF with RH (R = F, OH, NH2): A theoretical study

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2014, Russian Journal of Physical Chemistry A.

Novel formation of silicon–germanium bond: Insertion reactions of H2SiLiF with GeH3X (X = F, Cl, Br)

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2014 .

A new reaction mode of germanium-silicon bond formation: insertion reactions of H2GeLiF with SiH3X (X = F, Cl, Br)

Qingzhong Li, Wenzuo Li, Bingfei Yan, 2013, Journal of Molecular Modeling.

THEORETICAL INVESTIGATION ON THE INSERTION REACTIONS OF THE GERMYLENOID H2GeLiF WITH RH (R = Cl, SH, PH2)

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013 .

The insertion reactions of the germylenoid H2GeLiF with CH3X (X = F, Cl, Br)

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013 .

Theoretical investigation on H2 elimination reactions of germylenoid H2GeLiF with RH (R = F, OH, and NH2)

T. Liu, Qingzhong Li, Jian-Bo Cheng, 2010 .

Theoretical study of the cooperative effects between the triel bond and the pnicogen bond in BF3···NCXH2···Y (X = P, As, Sb; Y = H2O, NH3) complexes

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2015, Journal of Molecular Modeling.

The role of nitro group on the excited-state relaxation mechanism of P-Z base pair.

Qingzhong Li, Xue-fang Yu, B. Xiao, 2021, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Influence of the protonation of pyridine nitrogen on pnicogen bonding: competition and cooperativity.

Qingzhong Li, Jian-Bo Cheng, Yuanxin Wei, 2016, Physical chemistry chemical physics : PCCP.

Substitution, cooperative, and solvent effects on π pnicogen bonds in the FH2P and FH2As complexes

Qingzhong Li, Wenzuo Li, Xiaofeng Liu, 2012, Journal of Molecular Modeling.

Complexes between hypohalous acids and phosphine derivatives. Pnicogen bond versus halogen bond versus hydrogen bond.

Qingzhong Li, Hongying Zhuo, Xin Yang, 2014, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Noble gas matrix effects on the symmetric stretching transition structure of the XNgY noble gas molecules: Theoretical understanding the noble gas matrix stabilizing effects

Xianxi Zhang, Guoqun Liu, W. Zhang, 2014 .

Bandgap Engineering of Strained S-terminated MXene and Its Promising Application as NOx Gas Sensor

B. Xiao, Yan-chun Li, Qingzhong Li, 2022, Applied Surface Science.

Synthesis and bioimaging of a BODIPY-based fluorescence quenching probe for Fe3+

Jian-Bo Cheng, Zhenbo Liu, Shuang Liu, 2022, RSC advances.

Leveraging Doping and Defect Engineering to Modulate Exciton Dissociation in Graphitic Carbon Nitride for Photocatalytic Elimination of Marine Oil Spill

Huaiyong Zhu, Jianqiang Yu, Xiaolong Yang, 2022, Chemical Engineering Journal.

Competition between σ-hole pnicogen bond and π-hole tetrel bond in complexes of CF2=CFZH2 (Z = P, As, and Sb)

Qingzhong Li, Jian-Bo Cheng, Y. Wang, 2018, Molecular Physics.

Tetrel bond of pseudohalide anions with XH3F (X = C, Si, Ge, and Sn) and its role in SN2 reaction.

Haibei Li, Qingzhong Li, Jian-Bo Cheng, 2016, The Journal of chemical physics.

Tetrel bonds between PySiX3 and some nitrogenated bases: Hybridization, substitution, and cooperativity.

Qingzhong Li, Wenzuo Li, Mingxiu Liu, 2016, Journal of molecular graphics & modelling.

Competition and cooperativity between tetrel bond and chalcogen bond in complexes involving F2CX (X = Se and Te)

Qingzhong Li, Wenzuo Li, Jian-Bo Cheng, 2015 .

Competition of hydrogen, halogen, and pnicogen bonds in the complexes of HArF with XH2P (X=F, Cl, and Br).

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

The prominent enhancing effect and mechanism of the methyl group in the X···Y (X=O, S, H3CO, H3CS, (H3C)2O, (H3C)2S; Y=HCN, HNC) hydrogen-bonded complex

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2011 .

Competition between hydrogen bond and σ-hole interaction in SCS-HArF and SeCSe-HArF complexes

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2012 .

The structure, properties, and nature of HArF‐HOX (X = F, Cl, Br) complex: An ab initio study and an unusual short hydrogen bond

Qingzhong Li, Jun-Ling Zhao, Bo Jing, 2011, J. Comput. Chem..

AIE mechanism of 2-(2-hydroxyphenyl) benzothiazole derivatives: CASPT2 and spin-flip study

Jian-Bo Cheng, Xue-fang Yu, B. Xiao, 2022, Dyes and Pigments.

Li2Ni(WO4)2/C: A potential tungstate anode material for lithium ion batteries

K. Feng, Xin Yang, H. Cui, 2021 .

Substitution effect of superhalogens in MX3MCN-YF and MX3MCCY-NH3 complexes: Comparison with XMCN-YF and XMCCY-NH3

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2013 .

Cooperative and substitution effects in enhancing strengths of halogen bonds in FCl···CNX complexes.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012, The Journal of chemical physics.

Interplay between halogen bond and lithium bond in MCN‐LiCN‐XCCH (M = H, Li, and Na; X = Cl, Br, and I) complex: The enhancement of halogen bond by a lithium bond

Zhenbo Liu, Ran Li, Jian-Bo Cheng, 2011, J. Comput. Chem..

Surprising enhancing effect of methyl group on the strength of O⋯XF and S⋯XF (X=Cl and Br) halogen bonds.

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2010, The Journal of chemical physics.

Competition between hydrogen bond and halogen bond in complexes of formaldehyde with hypohalous acids.

Tao Liu, Jianbo Cheng, Qingzhong Li, 2010, Physical chemistry chemical physics : PCCP.

Non-additivity of methyl group in the single-electron halogen bond of CH3–BrH complex

Qingzhong Li, B. Gong, X. An, 2008 .

Triple proton transfer after water rearrangement in (2,6-aza)Ind·(H2O)2

Xue-fang Yu, Qingzhong Li, Cheng-bin Fu, 2022, Journal of Molecular Liquids.

Theoretical Design of Near-Infrared Fluorescent Sensor for F Anion Detection Based on 10-Hydroxybenzo[h]quinoline Backbone

Qingzhong Li, Zhenbo Liu, Xin Yang, 2019, ACS omega.

Structure and magnetic properties of open-ended silicon carbide nanotubes

Yan-Chun Li, Qingzhong Li, Jian-Bo Cheng, 2015 .

Influence of substituents on the nature of metal⋯π interaction and its cooperativity with halogen bond.

Qingzhong Li, Jian-Bo Cheng, Xin Yang, 2015, The Journal of chemical physics.

Comparison of hydrogen and halogen bonds between dimethyl sulfoxide and hypohalous acid: competition and cooperativity

Qingzhong Li, Jian-Bo Cheng, Xin Yang, 2017 .

Comparison of tetrel bonds and halogen bonds in complexes of DMSO with ZF3X (Z = C and Si; X = halogen)

Haibei Li, Qingzhong Li, Wenzuo Li, 2016 .

Structures, properties and nature of DMSO-XY (XY=ClF and BrF) complexes: redshift and blueshift of S=O stretch.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Comparison of contribution of OH⋯OS hydrogen bond and CH⋯Ow interaction to the methyl blueshift in hydration of dimethyl sulfoxide

Qingzhong Li, Jian-Bo Cheng, Xiulin An, 2008 .

Structures of the phosphinidene germylenoid HP=GeLiF and its cycloaddition reaction with ethylene

Qingzhong Li, Wenzuo Li, Bingfei Yan, 2018, Structural Chemistry.

Graphitic SiC : A potential anode material for Na‐ion battery with extremely high storage capacity

H. Cui, Qingzhong Li, Zhenbo Liu, 2021 .

Theoretical prediction on low-lying states of HAlP and HPAl radicals

Qingzhong Li, Wenzuo Li, Cuiping Xiao, 2013 .

Spin-orbit ab initio investigation of the photodissociation of C2H5Br

Qingzhong Li, Wenzuo Li, Cuiping Xiao, 2013, Structural Chemistry.

THEORETICAL STUDY ON HBeP- AND HPBe- ANIONS USING MULTICONFIGURATION SECOND-ORDER PERTURBATION THEORY

Qingzhong Li, Wenzuo Li, Yu-Wei Pei, 2012 .

CASPT2 study on HAlN and HNAl radicals

Qingzhong Li, Wenzuo Li, Yu-Wei Pei, 2012 .

Theoretical prediction on HAlS+ and HSAl+ cations using multiconfiguration second-order perturbation theory

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012 .

Theoretical prediction on low-lying states of HBP and HPB radicals

Qingzhong Li, Wenzuo Li, Yu-Wei Pei, 2012 .

CASPT2 study on low-lying states of HBS+ and HSB+ cations

Qingzhong Li, Wenzuo Li, Yu-Wei Pei, 2011 .

Cooperative effects between π-hole triel and π-hole chalcogen bonds

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2018, RSC advances.

Mg intercalation into Ti2C building block

Qingzhong Li, Zhenbo Liu, Xin Yang, 2015 .

Synergistic and diminutive effects between halogen bond and lithium bond in complexes involving aromatic compounds

Qingzhong Li, Wenzuo Li, Mingxiu Liu, 2015, Journal of Molecular Modeling.

Influence of the nature of hydrogen halides and metal cations on the interaction types between borazine and hydrogen halides

Qingzhong Li, Jian-Bo Cheng, Hongying Zhuo, 2014, Journal of Molecular Modeling.

Competition of chalcogen bond, halogen bond, and hydrogen bond in SCSHOX and SeCSeHOX (X = Cl and Br) complexes

Qingzhong Li, Wenzuo Li, Hui Li, 2012 .

Competition and cooperativity between hydrogen bond and σ-hole bond in SCS–(HF)n (n = 1 and 2) systems

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2010 .

Ab initio study of the structure, cooperativity, and vibrational properties of HNC ternary complexes with two HF molecules

Qingzhong Li, Jia-Zhong Sun, B. Gong, 2009 .

Cooperativity between two types of hydrogen bond in H(3)C-HCN-HCN and H(3)C-HNC-HNC complexes.

F. Luan, Qingzhong Li, Jian-Bo Cheng, 2008, The Journal of chemical physics.

Some measures for making a traditional halogen bond be chlorine-shared or ion-pair one in FCl•NH3 complex

Qingzhong Li, Jian-Bo Cheng, Hui-Li Xu, 2016 .

Enhancement of iodine-hydride interaction by substitution and cooperative effects in NCX-NCI-HMY complexes.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012, Chemphyschem : a European journal of chemical physics and physical chemistry.

Competition between π-hole interaction and hydrogen bond in the complexes of F2XO (X = C and Si) and HCN

Qingzhong Li, Wenzuo Li, L. Cao, 2014, Journal of Molecular Modeling.

CASPT2 study on low‐lying states of HMgO and HOMg

Qingzhong Li, Wenzuo Li, Yu-Wei Pei, 2012 .

Theoretical study on low‐lying states of HAlO+ and HOAl+ cations

Qingzhong Li, Wenzuo Li, Yu-Wei Pei, 2011 .

Assignment on the X, A, B, C, and D states of the C6H5Br+ cation based on high‐level calculations

Qingzhong Li, Wenzuo Li, Jia-Zhong Sun, 2010 .

Theoretical prediction on HBeN− and HNBe− anions using multiconfiguration second-order perturbation theory

Qingzhong Li, Wenzuo Li, Jia-Zhong Sun, 2010 .

Theoretical study on HBO+ and HOB+ cations using multiconfiguration second‐order perturbation theory

Jian-Bo Cheng, Qing-Zhong Li, Wen-Zuo Li, 2009, J. Comput. Chem..

CASPT2 study on low‐lying states of HBN and HNB radicals

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2011 .

Theoretical study on HBC− and HCB− anions using multiconfiguration second-order perturbation theory

Qingzhong Li, Wenzuo Li, Jia-Zhong Sun, 2009 .

Stabilization of Prussian blue analogues using clay minerals for selective removal of cesium

Shubin Yang, Jian-Bo Cheng, Baozhen Xie, 2021, Journal of Molecular Liquids.

Gas-phase activation of methane with PtOH+

Shaoli Liu, Qingzhong Li, Wenzuo Li, 2018, Computational and Theoretical Chemistry.

Prominent enhancing effects of substituents on the strength of π···σ‐hole tetrel bond

Haibei Li, Qingzhong Li, Jian-Bo Cheng, 2017 .

Comparative study of XO···ClF and XS···ClF (X = H, CH3, and F) halogen‐bonded complexes

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2010 .

Surprising enhancing effect of methyl group on the strength of O⋯XF and S⋯XF (X=Cl and Br) halogen bonds.

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2010, The Journal of chemical physics.

An unconventional halogen bond with carbene as an electron donor: An ab initio study

Jianbo Cheng, Qingzhong Li, Zhenbo Liu, 2009 .

Nonadditivity of methyl group in single‐electron hydrogen bond of methyl radical‐water complex

Qingzhong Li, Jian-Bo Cheng, Xiulin An, 2009 .

Surface-enhanced Raman spectroscopy and density functional theory study on 4,4'-bipyridine molecule.

Bing Zhao, Xiaoxia Han, Jian-Bo Cheng, 2007, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Spectroscopy of 4,4'-azopyridine by density functional theory and surface-enhanced Raman scattering

Bing Zhao, Gang Zhang, Xu Wang, 2006 .

Vibrational spectroscopy and density functional theory study on 1,4-bis[2-(4-pyridyl) ethenyl]-benzene

Xiaoling Li, Wei Song, Bing Zhao, 2005 .

Competition between dihydrogen bond and beryllium bond in complexes between HBeH and HArF: a huge blue shift of distant H-Ar stretch.

Qingzhong Li, Jian-Bo Cheng, Wenzuo Li, 2012, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Comparison of σ-Hole and π-Hole Tetrel Bonds Formed by Pyrazine and 1,4-Dicyanobenzene: The Interplay between Anion-π and Tetrel Bonds.

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2017, Chemphyschem : a European journal of chemical physics and physical chemistry.

The prominent enhancing effect of the cation-π interaction on the halogen-hydride halogen bond in M1⋅⋅⋅C6H5X⋅⋅⋅HM2.

Qingzhong Li, Jian-Bo Cheng, Zhenbo Liu, 2011, Chemphyschem : a European journal of chemical physics and physical chemistry.

Regulating function of methyl group in strength of CH...O hydrogen bond: a high-level ab initio study.

F. Luan, Qingzhong Li, Wenzuo Li, 2008, The journal of physical chemistry. A.

Structures of the germylenoid H2GeZnCl2 and its addition reactions with ethylene

Qingzhong Li, Wenzuo Li, Bingfei Yan, 2016, Structural Chemistry.

New insights into the insertion reactions of germylenoid H2GeLiF with RH (R = F, OH, NH2)

Qingzhong Li, Zhenbo Liu, Wenzuo Li, 2015, Journal of Molecular Modeling.