N-Functionalized MXenes: ultrahigh carrier mobility and multifunctional properties

Yangfan Shao, Fang Zhang, Xingqiang Shi and Hui Pan

Phys. Chem. Chem. Phys., 2017, 19, 28710
DOI: 10.1039/C7CP05816K

Prediction of induced magnetism in 2D Ti2C based MXenes by manipulating the mixed surface functionalization and metal substitution computed by xTB model Hamiltonian of the DFTB method

Taoufik Sakhraoui and František Karlický

Phys. Chem. Chem. Phys., 2024, 26, 12862
DOI: 10.1039/D3CP05665A

Intriguing electronic, optical and photocatalytic performance of BSe, M2CO2monolayers and BSe–M2CO2(M = Ti, Zr, Hf) van der Waals heterostructures

M. Munawar, M. Idrees, Iftikhar Ahmad, H. U. Din and B. Amin

RSC Adv., 2022, 12, 42
DOI: 10.1039/D1RA07569A

Revealing the electronic, optical and photocatalytic properties of PN-M2CO2 (P = Al, Ga; M = Ti, Zr, Hf) heterostructures

M. Munawar, M. Idrees, Tahani A. Alrebdi and B. Amin

Nanoscale Adv., 2023, 5, 1405
DOI: 10.1039/D3NA00017F

A first-principles study on antiferromagnetic VYNF2 with flat robust bands, valley splitting, and an out-of-plane piezoelectric response

Qiang Gao, Tingting Lin, Wei Wang, Guimei Shi, Xin Jin and Chen Shen

J. Mater. Chem. C, 2025, 13, 6375
DOI: 10.1039/D4TC04883K

Anisotropic strain in epitaxial single-layer molybdenum disulfide on Ag(110)

Luca Bignardi, Sanjoy K. Mahatha, Daniel Lizzit, Harsh Bana, Elisabetta Travaglia, Paolo Lacovig, Charlotte Sanders, Alessandro Baraldi, Philip Hofmann and Silvano Lizzit

Nanoscale, 2021, 13, 18789
DOI: 10.1039/D1NR05584D

Many-body effects in an MXene Ti2CO2 monolayer modified by tensile strain: GW-BSE calculations

Yi-min Ding, Xiaomin Nie, Huilong Dong, Nopporn Rujisamphan and Youyong Li

Nanoscale Adv., 2020, 2, 2471
DOI: 10.1039/C9NA00632J

Optoelectronic and solar cell applications of Janus monolayers and their van der Waals heterostructures

M. Idrees, H. U. Din, R. Ali, G. Rehman, T. Hussain, C. V. Nguyen, Iftikhar Ahmad and B. Amin

Phys. Chem. Chem. Phys., 2019, 21, 18612
DOI: 10.1039/C9CP02648G

Intriguing electronic structures and optical properties of two-dimensional van der Waals heterostructures of Zr2CT2 (T = O, F) with MoSe2 and WSe2

Gul Rehman, S. A. Khan, B. Amin, Iftikhar Ahmad, Li-Yong Gan and Muhammad Maqbool

J. Mater. Chem. C, 2018, 6, 2830
DOI: 10.1039/C7TC05963A

Enhancing CO2 electroreduction performance through transition metal atom doping and strain engineering in γ-GeSe: a first-principles study

Yu-wang Sun, Lei Liu and Jing-yao Liu

Phys. Chem. Chem. Phys., 2024, 26, 3560
DOI: 10.1039/D3CP05276A

First principles modeling of composites involving TiO2 clusters supported on M2C MXenes

Masoomeh Keyhanian, Néstor García-Romeral, Ángel Morales-García, Francesc Viñes and Francesc Illas

Phys. Chem. Chem. Phys., 2024, 26, 25319
DOI: 10.1039/D4CP01757A

Two-dimensional tetragonal AlOX (X = Cl, Br, or I) monolayers with promising photocatalytic performance: first-principles investigations

Yijing Ren, Xinguo Ma, Gang Yuan, Jiajun Liao, Nan Ma, Di Li and Hui Lv

Phys. Chem. Chem. Phys., 2024, 26, 16765
DOI: 10.1039/D4CP00233D

Exploring the properties of Zr2CO2/GaS van der Waals heterostructures for optoelectronic applications

Altaf Ur Rahman, Muhammad Abdul, Altaf Karim, Gul Rahman, Islam H. El Azab and Bao Jingfu

Phys. Chem. Chem. Phys., 2024, 26, 21453
DOI: 10.1039/D4CP02370F

MSSe-N2CO2 (M = Mo, W and N = Zr, Hf) van der Waals heterostructures; A first principles study

Qaisar Alam, M. Idrees, S. Muhammad and B. Amin

Chemical Physics, 2022, 561, 111607
DOI: 10.1016/j.chemphys.2022.111607

High carrier mobility and polarization sensitivity of AlN/Hf2CO2 heterojunction photodetector

Zhen Cui, Xin Gao, Shuang Zhang and Lu Wang

Chinese Journal of Physics, 2024, 91, 421
DOI: 10.1016/j.cjph.2024.07.046

Tuning the photoelectric properties of ZrS2/ZrSe2 heterojunction via shear strain and electric field

Yanshen Zhao, Lu Yang, Xingbin Wei, Huaidong Liu and Shihang Sun

Chemical Physics, 2025, 589, 112518
DOI: 10.1016/j.chemphys.2024.112518

Rational Design of Flexible Two-Dimensional MXenes with Multiple Functionalities

Zhongheng Fu, Ning Wang, Dominik Legut, Chen Si, Qianfan Zhang, Shiyu Du, Timothy C. Germann, Joseph S. Francisco and Ruifeng Zhang

Chem. Rev., 2019, 119, 11980
DOI: 10.1021/acs.chemrev.9b00348

Two-dimensional M2CO2/MoS2 (M = Ti, Zr and Hf) van der Waals heterostructures for overall water splitting: A density functional theory study

Xuewen Xu, Xiaoli Ge, Xin Liu, Lanlan Li, Kun Fu, Yao Dong, Fanbin Meng, Ruihao Si and Minghui Zhang

Ceramics International, 2020, 46, 13377
DOI: 10.1016/j.ceramint.2020.02.119

Effect of NH3 preadsorption on SO2 adsorption on Hf2CO2 MXene

Rui-Zhou Zhang, Xiao-Hong Li and Hong-Ling Cui

Solid State Communications, 2024, 392, 115667
DOI: 10.1016/j.ssc.2024.115667

Strain-tunable electronic and optical absorption in the MXenes nanolayers: A DFT approach

Zahra Ashkavandi, Abbas Zarifi and Esmaeil Pakizeh

Journal of Solid State Chemistry, 2024, 339, 124975
DOI: 10.1016/j.jssc.2024.124975

Electronic structure and optical properties of BiSI/BiSeI heterojunctions

Deming Ma, Yuhui Fu, Jinchi Hu, Xiaoyu Yang, Mengxia Li, Weili Ji, Enling Li and Zhen Cui

Journal of Physics and Chemistry of Solids, 2025, 199, 112539
DOI: 10.1016/j.jpcs.2024.112539

Strain adjustment Pt-doped Ti2CO2 as an efficient bifunctional catalyst for oxygen reduction reactions and oxygen evolution reactions by first-principles calculations

Ninggui Ma, Na Li, Yaqin Zhang, Tairan Wang, Jun Zhao and Jun Fan

Applied Surface Science, 2022, 590, 153149
DOI: 10.1016/j.apsusc.2022.153149

Strain dependent physical properties of the lead-free perovoskite ZnZrO3 for energy device applications

Mubashir Hussain, Farooq Ali, Hamid Ullah, Asghar Ali, Young-Han Shin and Khalid M. Elhindi

Solid State Communications, 2025, 397, 115846
DOI: 10.1016/j.ssc.2025.115846

Effect of the biaxial strain on the electronic structure, quantum capacitance of NH3 adsorption on pristine Hf2CO2 MXene using first-principles calculations

Shan-Shan Li, Xiao-Hong Li, Xing-Hao Cui, Rui-Zhou Zhang and Hong-Ling Cui

Applied Surface Science, 2022, 575, 151659
DOI: 10.1016/j.apsusc.2021.151659

Low-dimensional MXenes as noble metal-free co-catalyst for solar-to-fuel production: Progress and prospects

Wanying Lei, Tong Zhou, Xin Pang, Shixiang Xue and Quanlong Xu

Journal of Materials Science & Technology, 2022, 114, 143
DOI: 10.1016/j.jmst.2021.10.029

First-principle study of electronic, optical, quantum capacitance, carrier mobility and photocatalytic properties of Zr2CO2 MXene under uniaxial strain

Hao Zhang, Xiao-Hong Li, Rui-Zhou Zhang and Hong-Ling Cui

Vacuum, 2024, 220, 112813
DOI: 10.1016/j.vacuum.2023.112813

First-principles study of metal-semiconductor contact OF CS and X2CO2 (X=Ti, Zr, Hf) monolayers

M.U. Ashraf, Haya Khan, M. Munawar, Haleem Ud Din, M. Idrees, M. Bilal, Y. Saeed, M. Shafiq and B. Amin

Materials Science in Semiconductor Processing, 2022, 141, 106424
DOI: 10.1016/j.mssp.2021.106424

2D Li2S monolayer: A global minimum lithium sulfide sandwich

Mosayeb Naseri and Shiru Lin

Chemical Physics Letters, 2019, 722, 58
DOI: 10.1016/j.cplett.2019.02.047

First-principles study of structural, electronic and magnetic properties of transition metal doped Sc2CF2 MXene

Rui-Zhou Zhang, Xing-Hao Cui, Hong-Ling Cui and Xiao-Hong Li

Applied Surface Science, 2022, 581, 152360
DOI: 10.1016/j.apsusc.2021.152360

Optoelectronic and photocatalytic properties of Mo-based Janus monolayers for solar cell applications

Hafiza Sumaira Waheed, Hamid Ullah, M. Waqas Iqbal and Young-Han Shin

Optik, 2022, 271, 170071
DOI: 10.1016/j.ijleo.2022.170071

Doped MXenes—A new paradigm in 2D systems: Synthesis, properties and applications

Avishek Dey, Silvia Varagnolo, Nicholas P Power, Naresh Vangapally, Yuval Elias, Lois Damptey, Bright N. Jaato, Saianand Gopalan, Zahra Golrokhi, Prashant Sonar, Vimalnath Selvaraj, Doron Aurbach and Satheesh Krishnamurthy

Progress in Materials Science, 2023, 139, 101166
DOI: 10.1016/j.pmatsci.2023.101166

Photocatalytic Z-Schemes for the Overall Water Splitting to Produce Hydrogen with ZnAl2Se4/XSe2 (X= Ti, Zr, Hf) Heterostructures

Hao Sun, ChuanLu Yang and Xiaohu Li

Surfaces and Interfaces, 2025, 56, 105661
DOI: 10.1016/j.surfin.2024.105661

Electronic structures, optical properties and quantum capacitance of 2D Janus ZrMCO2 (M = Sc, Ti, V, Cr, Mn, Fe, Y, Zr, Nb, Mo, Hf, Ta, W) MXenes for supercapacitor electrodes

Hao Zhang, Xiao-Hong Li, Rui-Zhou Zhang and Hong-Ling Cui

Ceramics International, 2024, 50, 18932
DOI: 10.1016/j.ceramint.2024.02.381

Tuning electronic and transport properties of MoS2/Ti2C heterostructure by external strain and electric field

Chenliang Li, Guoxun Wu, Chaoying Wang, Yi Fu and Baolai Wang

Computational Materials Science, 2018, 153, 417
DOI: 10.1016/j.commatsci.2018.07.010

Two-dimensional MXenes: From morphological to optical, electric, and magnetic properties and applications

Xiantao Jiang, Artem V. Kuklin, Alexander Baev, Yanqi Ge, Hans Ågren, Han Zhang and Paras N. Prasad

Physics Reports, 2020, 848, 1
DOI: 10.1016/j.physrep.2019.12.006

Strain Engineering of Cu2O@C2N for Enhanced Methane-to-Methanol Conversion

Shuxin Kuai, Bo Li and Jingyao Liu

Molecules, 2025, 30, 3073
DOI: 10.3390/molecules30153073

Strain engineering and electric field tunable electronic properties of Ti2CO2 MXene monolayer

Khang D Pham, Nguyen V Hieu, Le M Bui, Igor V Ershov, Nguyen N Hieu, Huynh V Phuc, Bui D Hoi, Le T T Phuong, Le M Duc, M Idrees, Bin Amin and Chuong V Nguyen

Mater. Res. Express, 2019, 6, 065910
DOI: 10.1088/2053-1591/ab0e1e

Strain-tunable electronic structures and optical properties of semiconducting MXenes

Jingjing Cui, Qiong Peng, Jian Zhou and Zhimei Sun

Nanotechnology, 2019, 30, 345205
DOI: 10.1088/1361-6528/ab1f22

Surface termination dependence of electronic and optical properties in Ti2CO2 MXene monolayers

Zafer Kandemir, Engin Torun, Fulvio Paleari, Celal Yelgel and Cem Sevik

Phys. Rev. Materials, 2022, 6
DOI: 10.1103/PhysRevMaterials.6.026001

Scrutinized the spin-orbit coupling effect on the elastically and thermodynamically stable Rb2BCl6 (B = Pb, Ti) double perovskites for photocatalytic, optoelectronic and renewable energy applications

Moeen Ud Din, Junaid Munir, Thamraa Alshahrani, H.I. Elsaeedy and Quratul Ain

Materials Science in Semiconductor Processing, 2023, 163, 107569
DOI: 10.1016/j.mssp.2023.107569

Strain-induced changes of electronic and optical properties of Zr-based MXenes

Jiří Kalmár and František Karlický

Journal of Applied Physics, 2024, 135
DOI: 10.1063/5.0205991

Mo2TiC2O2 MXene-based nanoscale pressure sensor

Ünal Özden Akkuş, Erdem Balcı and Savas Berber

Physica E: Low-dimensional Systems and Nanostructures, 2020, 116, 113762
DOI: 10.1016/j.physe.2019.113762

Strain engineering of electronic properties, quantum capacitance, and photocatalytic properties of Zr2CO2 MXene

Hao Zhang, Xiao-Hong Li, Rui-Zhou Zhang and Hong-Ling Cui

Molecular Catalysis, 2023, 547, 113330
DOI: 10.1016/j.mcat.2023.113330

Tuning electronic structures and optical properties of Ti2CO2 MXenes by applying stress

Chang Chen, Lina Bai and Li Niu

Physica B: Condensed Matter, 2023, 661, 414940
DOI: 10.1016/j.physb.2023.414940

Strain‐tunable electronic properties and optical properties of Hf2CO2 MXene

Shan‐Shan Li, Xiao‐Hong Li, Rui‐Zhou Zhang and Hong‐Ling Cui

Int J of Quantum Chemistry, 2020, 120
DOI: 10.1002/qua.26365

MXene as Emerging Low Dimensional Material in Modern Energy and Bio Application: A Review

A. Arifutzzaman, Chin Fhong Soon, Marlia Morsin, Gim Pao Lim, Navid Aslfattahi, Warsuzarina Mat Jubadi, Sangeetha Siva Sangu, Mohamed Shuaib Mohamed Saheed, Nafarizal Nayan and Rahman Saidur

JNanoR, 2022, 74, 109
DOI: 10.4028/p-x49od6

Insights into electronic and magnetic properties of MXenes: From a fundamental perspective

Yiran Li, Mengling Lai, Minmin Hu, Shijun Zhao, Bin Liu and Ji-Jung Kai

Sustainable Materials and Technologies, 2022, 34, e00516
DOI: 10.1016/j.susmat.2022.e00516

Strain Engineering and Electric Field Tunable Electronic Properties of Janus MoSSe/WX2 (X = S, Se) van der Waals Heterostructures

Chen Yu and Zhiguo Wang

Physica Status Solidi (b), 2019, 256
DOI: 10.1002/pssb.201900261

Effect of preadsorbing gas molecules on the adsorption of SO2 molecule on Hf2CO2 MXene by first-principles study

Lu Li, Hai-Tao Yan and Xiao-Hong Li

Surfaces and Interfaces, 2023, 36, 102639
DOI: 10.1016/j.surfin.2023.102639

Quantum capacitance of supercapacitor electrodes based on the F-functionalized M2C MXenes: A first-principles study

Hai-Tao Yan, Xiao-Hong Li, Ming-Zhu Liu, Xing-Hao Cui, Shan-Shan Li and Hong-Ling Cui

Vacuum, 2022, 201, 111094
DOI: 10.1016/j.vacuum.2022.111094

Tunable Schottky barrier and contact types in TaX2-M2CO2 (X=S, Se, Te; M= Ti, Hf, Zr) van der Waals Heterostructure

A. Mustaqeem, Israr Ul Haq, B. Ali, U. Khan, M. Bilal, A. Ekicibil, Q. Alam and B. Amin

Surfaces and Interfaces, 2025, 72, 107095
DOI: 10.1016/j.surfin.2025.107095

A computational prediction of a novel quasi hexagonal Al2SSi semiconductor monolayer

Tahereh Shirnezhad, Negin Fatahi and Mosayeb Naseri

Chemical Physics, 2021, 545, 111148
DOI: 10.1016/j.chemphys.2021.111148

Intriguing electronic and optical properties of M2CX2 (M = Mo, W; X = O, F) MXenes and their van der Waals heterostructures

S.A. Khan, Gul Rehman, Iftikhar Ahmad, M. Maqbool, Cesare Franchini and B. Amin

Chemical Physics Letters, 2019, 731, 136614
DOI: 10.1016/j.cplett.2019.136614

Quantum insights into O-terminated transition metal carbides: Structural and functional perspective for energy solutions

Fakhra Ghafoor, Khawar Ismail, Muhammad Aftab Rafiq, Munawar Ali and Fizza Siddique

Physica B: Condensed Matter, 2025, 701, 416964
DOI: 10.1016/j.physb.2025.416964

Strain–Spintronics: Modulating Electronic and Magnetic Properties of Hf2MnC2O2 MXene by Uniaxial Strain

Edirisuriya M. D. Siriwardane, Pragalv Karki, Yen Lee Loh and Deniz Çakır

J. Phys. Chem. C, 2019, 123, 12451
DOI: 10.1021/acs.jpcc.9b00594

MXenes and their derivatives as nitrogen reduction reaction catalysts: recent progress and perspectives

Tahta Amrillah, Angga Hermawan, Vani Novita Alviani, Zhi Wei Seh and Shu Yin

Materials Today Energy, 2021, 22, 100864
DOI: 10.1016/j.mtener.2021.100864

Two-dimensional Hf2CO2/GaN van der Waals heterostructure for overall water splitting: a density functional theory study

Minghui Zhang, Ruihao Si, Xiaoyi Wu, Yao Dong, Kun Fu, Xuewen Xu, Jun Zhang, Lanlan Li and Yue Guo

J Mater Sci: Mater Electron, 2021, 32, 19368
DOI: 10.1007/s10854-021-06454-9

Structural and energetic properties of vacancy defects in MXene surfaces

José D. Gouveia and José R. B. Gomes

Phys. Rev. Materials, 2022, 6
DOI: 10.1103/PhysRevMaterials.6.024004

The Photocatalytic Performance of JANUS SXSiN2 (X = Cr, Mo, W) Monolayers with Enhanced Carrier Migration

Wei Cai, Yuhua Chi, Mengxin Ji, Qian Zhang, Hao Ren, Houyu Zhu, Wen Zhao and Wenyue Guo

Catal Lett, 2024, 154, 6195
DOI: 10.1007/s10562-024-04818-4

A first-principles study of the electronic and optical properties of monolayer α-PbO

Amin Masihi, Mosayeb Naseri and Negin Fatahi

Chemical Physics Letters, 2019, 721, 27
DOI: 10.1016/j.cplett.2019.02.022

Effect of the normal compressive strain and electric filed on the electronic and optical properties of Zr2CO2 MXene and MoSe2 van der Waals Heterojunction: A first principles calculation

Rui-Zhou Zhang, Xiao-Hong Li, Shan-Shan Li, Xing-Hao Cui and Hong-Ling Cui

Vacuum, 2021, 190, 110290
DOI: 10.1016/j.vacuum.2021.110290

First-Principles Calculations of 2D Janus WSSiN2Monolayer for Photocatalytic Water Splitting

Gang Yuan, Xinguo Ma, Jiajun Liao, Tian Xie, Qihai Xie and Zhongyong Yuan

ACS Appl. Nano Mater., 2023, 6, 1956
DOI: 10.1021/acsanm.2c04918

Unraveling the multiscale damping properties of two-dimensional layered MXene

Archana Loganathan, Pranjal Nautiyal, Benjamin Boesl and Arvind Agarwal

Nanomaterials and Energy, 2019, 8, 84
DOI: 10.1680/jnaen.18.00022

A novel highly selective and sensitive NH3 gas sensor based on monolayer Hf2CO2

Yiran Wang, Shuhong Ma, Lifang Wang and Zhaoyong Jiao

Applied Surface Science, 2019, 492, 116
DOI: 10.1016/j.apsusc.2019.06.212

Biaxial strain tunable quantum capacitance and photocatalytic properties of Hf2CO2 monolayer

Xing-Hao Cui, Xiao-Hong Li, Xiu-Juan Jin, Hai-Tao Yan, Rui-Zhou Zhang and Hong-Ling Cui

Applied Surface Science, 2023, 616, 156579
DOI: 10.1016/j.apsusc.2023.156579

Intriguing optoelectronic and visible-light activated photocatalytic properties of 2D AlN/GaN and TMDCs (MX2; M = Mo/W, X = S/Se) monolayers and their bilayer vdWs heterostructures

Aqsa Abid, Bo Li, Muhammad Haneef, Attaur Rahman and Yasser Elmasry

Eur. Phys. J. Plus, 2024, 139
DOI: 10.1140/epjp/s13360-024-05814-8

Tuning the magnetic properties of Zr2N MXene by biaxial strain

Yunliang Yue, Buwei Wang, Nanxi Miao, Chao Jiang, Hongwei Lu, Bowen Zhang, Yankai Wu, Jie Ren and Min Wang

Ceramics International, 2021, 47, 2367
DOI: 10.1016/j.ceramint.2020.09.079

Janus MoSO and MoSSe Monolayers: A Promising Material for Solar Cells and Photocatalytic Applications

Hafiza Sumaira Waheed, Mazia Asghar, Hafiz Saeed Ahmad, Tasawar Abbas, Hamid Ullah, Roshan Ali, Muhammad Junaid Iqbal Khan, Muhammad Waqas Iqbal, Young-Han Shin, Muhammad Sheraz Khan and Riadh Neffati

Physica Status Solidi (b), 2023, 260
DOI: 10.1002/pssb.202200267

Electronic Nature Transition and Magnetism Creation in Vacancy-Defected Ti2CO2 MXene under Biaxial Strain: A DFTB + U Study

Taoufik Sakhraoui and František Karlický

ACS Omega, 2022, 7, 42221
DOI: 10.1021/acsomega.2c05037

Two dimensional Zr2CO2/H-FeCl2 van der Waals heterostructures with tunable band gap, potential difference and magnetic anisotropy

Xianghui Duan, Baozeng Zhou, Xiaocha Wang and Wenbo Mi

J. Phys.: Condens. Matter, 2023, 35, 024001
DOI: 10.1088/1361-648X/ac9f99

Strain-tunable electronic and optical properties of Zr2CO2 MXene and MoSe2 van der Waals heterojunction: A first principles calculation

Xiao-Hong Li, Xing-Hao Cui, Cai-Hong Xing, Hong-Ling Cui and Rui-Zhou Zhang

Applied Surface Science, 2021, 548, 149249
DOI: 10.1016/j.apsusc.2021.149249

Density functional theory study of the electronic properties and quantum capacitance of pure and doped Zr2CO2 as electrode of supercapacitors

Shuo Xu, Shi‐Jie Wang, Wan‐Qi Sun, Xiao‐Hong Li and Hong‐Ling Cui

Int J of Quantum Chemistry, 2022, 122
DOI: 10.1002/qua.26844

Exploring the sensitivity of Hf2CO2 towards H2S: a DFT study

Tongwei Li, Jing Chen, Kai Tian, Qingxiao Zhou, Mengjie Li and Weiwei Ju

Molecular Physics, 2023, 121
DOI: 10.1080/00268976.2023.2188975

Strain engineering of electronic and magnetic properties of double-transition metal ferromagnetic semiconductor MXenes

Edirisuriya M. D. Siriwardane and Deniz Çakir

Journal of Applied Physics, 2019, 125
DOI: 10.1063/1.5054131

Theoretical investigation of electronic structure and thermoelectric properties of MX2 (M=Zr, Hf; X=S, Se) van der Waals heterostructures

Fawad Khan, H.U. Din, S.A. Khan, G. Rehman, M. Bilal, Chuong V. Nguyen, Iftikhar Ahmad, Li-Yong Gan and B. Amin

Journal of Physics and Chemistry of Solids, 2019, 126, 304
DOI: 10.1016/j.jpcs.2018.11.021

Improvement of Visible-Light Photocatalytic Efficiency in a Novel InSe/Zr2CO2 Heterostructure for Overall Water Splitting

Yong He, Min Zhang, Jun-jie Shi, Yu-lang Cen and Meng Wu

J. Phys. Chem. C, 2019, 123, 12781
DOI: 10.1021/acs.jpcc.9b01175

Adsorption of monolayer penta-CdSe2 by 3d transition-metal atoms and their dimers: A first-principles study

Xiao-Ping Wei, Jiang-Liu Meng, Hao-Kai Sun, Ya-Ling Zhang and Xiaoma Tao

Surfaces and Interfaces, 2024, 53, 105055
DOI: 10.1016/j.surfin.2024.105055