Doudou Zhang, Weisheng Pan, Haijiao Lu, Zhiliang Wang, Bikesh Gupta, Aman Maung Than Oo, Lianzhou Wang, Karsten Reuter, Haobo Li, Yijiao Jiang and Siva Karuturi

Applied Physics Reviews, 2025, 12
DOI: 10.1063/5.0281416

Transformative strategies in photocatalyst design: merging computational methods and deep learning

Jianqiao Liu, Liqian Liang, Boru Su, Di Wu, Yuequ Zhang, Jianzhao Wu and Ce Fu

J Mater Inf, 2024, 4
DOI: 10.20517/jmi.2024.48

Influence and applications of refractive index on the catalytic perfomance of photo-responsive materials

Nelson Oshogwue Etafo, Aisha Okmi, Sreedeep Dey, Hanan Alzahrani and Abayomi Bamisaye

Environmental Surfaces and Interfaces, 2025, 3, 237
DOI: 10.1016/j.esi.2025.09.004

Recent Advances in Photocatalysis: From Laboratory to Market

Abdul Wafi, Demas Aji and Mohammad Mansoob Khan

Results in Chemistry, 2025, 18, 102672
DOI: 10.1016/j.rechem.2025.102672

Light-driven simultaneous water purification and green energy production by photocatalytic fuel cell: A comprehensive review on current status, challenges, and perspectives

Jiahua Ni, Yanjun Wen, Donglai Pan, Jing Bai, Baoxue Zhou, Shuaifei Zhao, Zhuan Wang, Yanbiao Liu and Qingyi Zeng

Chemical Engineering Journal, 2023, 473, 145162
DOI: 10.1016/j.cej.2023.145162

Cocatalyst is matter: Cocatalyst engineering of photocatalysts on hydrogen evolution and carbon dioxide reduction

Kodong Bang, Jong‐Yeong Jung, Yunkyoung Han and Hyunjoon Song

Bulletin Korean Chem Soc, 2025, 46, 1028
DOI: 10.1002/bkcs.70076

Size dependent photogeneration charge carrier density of hollow ZnIn2S4 microspheres for enhanced photocatalytic activity

Pengfei Zhang, Jie Zhao, Chenyu Lu, Liang Huang, Jianfeng Lin, Zhaoyong Lin, Donglei Bu and Shaoming Huang

Chemical Engineering Journal, 2024, 489, 151331
DOI: 10.1016/j.cej.2024.151331

Progress in prediction of photocatalytic CO2 reduction using machine learning approach: A mini review

Md Mohshin Ali, Md. Arif Hossen and Azrina Abd Aziz

Next Materials, 2025, 8, 100522
DOI: 10.1016/j.nxmate.2025.100522

Machine Learning for Photocatalytic Materials Design and Discovery

David O. Obada, Shittu B. Akinpelu, Simeon A. Abolade, Mkpe O. Kekung, Emmanuel Okafor, Syam Kumar R, Aniekan M. Ukpong and Akinlolu Akande

Crystals, 2025, 15, 1034
DOI: 10.3390/cryst15121034

Combination of ensemble machine learning models in photocatalytic studies using nano TiO2 - Lignin based biochar

Abhayasimha K C, Chinta Sankar Rao and Vaishakh Nair

Chemosphere, 2024, 352, 141326
DOI: 10.1016/j.chemosphere.2024.141326

Ultrafast Charge Transfer and Delayed Recombination in a Type-II Ni3TeO6/MoSi2N4 Heterostructure: A Time-Domain Ab Initio Study

Arooba Kanwal, Yixue Duan, Zhen Dong, Zirui Jiang, Hao Fan, Abdul Jalil, Syed Raza Ali Raza and Mahalingam Ravi Varma

ACS Appl. Energy Mater., 2025, 8, 9840
DOI: 10.1021/acsaem.5c01469

CsPbBr3 Perovskite‐Based Heterostructures in Photocatalysis: Mechanisms, Stability, and Multifunctional Performance

Kuanxin Lv, Zhenzhen Li, Xing Huang, Zetong Cheng, Zhongyan Wang and Hang Zhao

Advanced Science, 2025, 12
DOI: 10.1002/advs.202507747

Mechanochemical synthesis of novel Z-scheme ZnIn2S4/Zn–Al layered double hydroxides heterojunction with performed photodegradation of SIPX xanthate from aqueous solution

Mingfei Sun, Yongwei Mao, Yu Na, Yumo Liu, Zhao Li, Min Chen, Pengcheng Li, Shujuan Dai and Tonglin Zhao

Materials Science in Semiconductor Processing, 2024, 177, 108406
DOI: 10.1016/j.mssp.2024.108406

Artificial intelligence-guided design of metal-doped polymeric carbon nitride/clay composites for increased photocatalytic hydrogen evolution

Wenan Cai, Yulin Xu, Huiwei Ding, Hajime Miki, Youhei Kawamura and Keiko Sasaki

Acta Physico-Chimica Sinica, 2026, 100246
DOI: 10.1016/j.actphy.2026.100246

Artificial Intelligence-Guided Supervised Learning Models for Photocatalysis in Wastewater Treatment

Asma Rehman, Muhammad Adnan Iqbal, Mohammad Tauseef Haider and Adnan Majeed

AI, 2025, 6, 258
DOI: 10.3390/ai6100258

Recent Advances in Diverse MXenes‐Based Structures for Photocatalytic CO2 Reduction into Renewable Hydrocarbon Fuels

Qijun Tang, Tianhao Li, Wenguang Tu, Haiqiang Wang, Yong Zhou and Zhigang Zou

Adv Funct Materials, 2024, 34
DOI: 10.1002/adfm.202311609

Machine learning in photocatalysis: accelerating design, understanding, and environmental applications

Siqing Tunala, Shaochong Zhai, Fangcao Wu and Yi-Hung Chen

Sci. China Chem., 2025, 68, 3415
DOI: 10.1007/s11426-024-2656-6

Electrophotocatalysis Versus Indirect Electrolysis: Electrochemical Selenocyclization of 3‐Aza‐1,5‐dienes Facilitated by Energy Transfer, Direct Photolysis or N‐Hydroxyphthalimide

Dongyin Wang, Li Zeng, Jifu Shi, Shulin Gao, Lou Shi, Shaoguang Sun and Deqiang Liang

Chemistry A European J, 2024, 30
DOI: 10.1002/chem.202400280

Multifunctional SnS/SnS2/ZSM-5 nanocomposite for efficient photodegradation: Coupled with experimentally validated machine learning predictive modeling

Megha Parmar, Varya Joshi, Mahuya Bandyopadhyay, Rama Gaur, Mohammed E․Ali Mohsin, Suleiman Mousa and Syed Shahabuddin

Surfaces and Interfaces, 2026, 87, 109003
DOI: 10.1016/j.surfin.2026.109003

The role of artificial intelligence in optimizing photocatalytic degradation technologies of dyes in textile wastewater: Recent advances, challenges, and prospects

Noureddine El Messaoudi, Youssef Miyah, Mohammed Benjelloun, Jordana Georgin, Dison S.P. Franco, Parminder Kaur, Vuanghao Lim and Salah Knani

Journal of Water Process Engineering, 2025, 77, 108457
DOI: 10.1016/j.jwpe.2025.108457

Carbon nitride based photocatalysts for CO2 photoreduction: Recent advances and future perspectives

Jiong-ran Lv, Rui-tang Guo, Hao-wen Zhu, Ming-yang Liu and Wei-guo Pan

Journal of Industrial and Engineering Chemistry, 2026, 153, 135
DOI: 10.1016/j.jiec.2025.06.010

Key components for realistic application of plastic photoreforming coupled with H2 evolution

Jinpeng Zhang, Teng Liang, Jaenudin Ridwan, Tian Chen, Elhussein M. Hashem, Meijun Guo, Amin Talebian-Kiakalaieh, Le Yu, Ping She and Jingrun Ran

Chinese Journal of Catalysis, 2026, 80, 20
DOI: 10.1016/S1872-2067(25)64869-8

Decoding the atomic architecture of photocatalytic active sites: From precise identification to rational design principles

Sixian Li, Youyu Duan, Xinyuan Liang, Yuhan Li and Dieqing Zhang

Chinese Journal of Catalysis, 2026, 83, 1
DOI: 10.1016/S1872-2067(26)64986-8

Integrating experimental and machine learning approaches for predictive analysis of photocatalytic hydrogen evolution using Cu/g-C3N4

Bahriyenur Arabacı, Rezan Bakır, Ceren Orak and Aslı Yüksel

Renewable Energy, 2024, 237, 121737
DOI: 10.1016/j.renene.2024.121737

Selective heterogeneous photocatalytic activation for toluene oxidation: recent advances, challenges and perspective

Shiqin Gao, Lisu Bai, Tao Gan and Bolun Wang

Chem Synth, 2025, 5
DOI: 10.20517/cs.2024.96

Multiscale Engineering of Graphitic Carbon Nitride for Photocatalytic Carbon Dioxide Reduction: From Atomic Structure to Smart Systems

Meijia Wang, Na Zhang, Xianyun Ma, Jiale Zhang and Yihe Zhang

Coordination Chemistry Reviews, 2026, 553, 217549
DOI: 10.1016/j.ccr.2025.217549

An in-depth study by machine learning models of the absorbance properties of stable Ta2O5 nanotubes decorated by PbS nanoparticles for photocatalytic applications

Ines Khemissi, Radhouane Laajimi, Kawther Ben Mabrouk, Anouar Hajjaji and Mehdi Rahmani

Materials Research Bulletin, 2025, 184, 113247
DOI: 10.1016/j.materresbull.2024.113247

Machine Learning-Assisted Screening of Hexagonal 2D van der Waals Bilayers for Photocatalysis

Arooba Kanwal, Abdul Jalil and Syed Raza Ali Raza

J. Phys. Chem. C, 2025, 129, 205
DOI: 10.1021/acs.jpcc.4c05495

AI‐Driven Modeling and Statistical Assessment of AgO/ZnO/g‐C3N4 Photocatalysts on Wastewater Treatment: Impact of UV–Visible Light

Büşra Yoney and Ömür Aras

ChemistrySelect, 2025, 10
DOI: 10.1002/slct.202501947

LnVO4 (Ln=La, Ce, Pr, Nd, etc.)-based photocatalysts: Synthesis, design, and applications

Liquan Jing, Yuanguo Xu, Meng Xie, Chongchong Wu, Heng Zhao, Jiu Wang, Hui Wang, Yubo Yan, Na Zhong, Huaming Li, Ian D. Gates and Jinguang Hu

Journal of Materials Science & Technology, 2024, 177, 10
DOI: 10.1016/j.jmst.2023.07.064

Predictive Modeling and Data-Driven Optimization of CdFe2O4/p-Si Heterojunction Electrical Behavior

Nejmeddine Yahyaoui, Mokhtar Hjiri, Slah Mansouri and Fahrettin Yakuphanoglu

ACS Omega, 2025, 10, 47643
DOI: 10.1021/acsomega.5c06499

Data‐Guided Photocatalysis: Supervised Machine Learning in Water Splitting and CO2 Conversion

Paul Rossener Regonia and Christian Mark Pelicano

adv. intell. discov., 2026
DOI: 10.1002/aidi.202500122

Recent advances in structural modification on graphitic carbon nitride (g-C 3N 4)-based photocatalysts for high-efficiency photocatalytic H 2O 2production

Feng Ming Yap, Grayson Zhi Sheng Ling, Brenden Jing Su, Jian Yiing Loh and Wee-Jun Ong

Nano Research Energy, 2024, 3, e9120091
DOI: 10.26599/NRE.2023.9120091

Advancing Transition Metal Oxide Photoelectrodes for Efficient Solar‐Driven Hydrogen Generation: Strategies and Insights

Abdul Ahad Mamun, Abir Hasan Chowdhury, Asif Billah, Jawadul Karim, Auronno Ovid Hussain, Faysal Rahman and Muhammad Anisuzzaman Talukder

Advanced Energy Materials, 2025, 15
DOI: 10.1002/aenm.202501766

Recent advances in industrial photoreactors: A review from design to large-scale applications

Borhan Pourtalebi, Reza Alizadeh and S. Majid Abdoli

Journal of Water Process Engineering, 2025, 77, 108619
DOI: 10.1016/j.jwpe.2025.108619

Unveiling the photoelectric and photocatalytic promise of two-dimensional lead-free perovskite/InX (X=Se, Te) van der Waals heterostructures

Jiansen Wen, Maojie Xie, Baisheng Sa, Naihua Miao, Cuilian Wen, Bo Wu, Jian Zhou and Zhimei Sun

Surfaces and Interfaces, 2024, 48, 104311
DOI: 10.1016/j.surfin.2024.104311

Adsorption and Photo(electro)catalysis for Micropollutant Degradation at the Outlet of Wastewater Treatment Plants: Bibliometric Analysis and Challenges to Implementation

Yunzhi Li, Julien G. Mahy and Stéphanie D. Lambert

Processes, 2025, 13, 1759
DOI: 10.3390/pr13061759

Gallium Nitride in Heterogeneous Photocatalysis: Fundamental Insights and Emerging Trends

Hyotaik Kang and Chao‐Jun Li

ChemistryEurope, 2025, 3
DOI: 10.1002/ceur.202500112

Solar Generated Hydrogen: 2D Heterostructures for Photocatalysts

Saba Shoaib, Faiza Arshad, Zhiyi Sun, Zilong Wu, Zebiao Li, Xinxin Lu, Wei Guo and Zhuo Chen

ACS Appl. Nano Mater., 2026
DOI: 10.1021/acsanm.5c05371

Predicting photodegradation rate constants of water pollutants on TiO2 using graph neural network and combined experimental-graph features

Mahia V. Solout and Jahan B. Ghasemi

Sci Rep, 2025, 15
DOI: 10.1038/s41598-025-04220-z

Convert Polymer Self‐Assembly Nanostructures into Target Functional Materials: An Art of Embattling Molecules

Zhi Zhao, Xiaotong Zheng, Yurong Li, Xuan Yao, Haibin Wang and Xiaoyan Song

Adv Funct Materials, 2024, 34
DOI: 10.1002/adfm.202409050

A machine learning based strategy towards enhanced photocatalytic reduction of CO2 to fuels via g-C3N4/TiO2: A comprehensive exploration of optimum parameters

Yash Kumar, Rishika Nair, J.R. Prashitha and G. Velvizhi

Computational and Theoretical Chemistry, 2025, 1252, 115351
DOI: 10.1016/j.comptc.2025.115351

Silicon Photocatalytic Water-Treatment: Synthesis, Modifications, and Machine Learning Insights

Abay S. Serikkanov, Nurlan B. Bakranov, Tunyk K. Idrissova, Dina I. Bakranova and Danil W. Boukhvalov

Nanomaterials, 2025, 15, 1514
DOI: 10.3390/nano15191514

Defect engineering in two-dimensional materials for photocatalysis: A mini-review of first-principles design

Yiqing Chen, Xiao-Yan Li and Pengfei Ou

Front. Energy, 2025, 19, 59
DOI: 10.1007/s11708-024-0961-5

Recent Advancements in Applying Machine Learning in Power-to-X Processes: A Literature Review

Seyed Mohammad Shojaei, Reihaneh Aghamolaei and Mohammad Reza Ghaani

Sustainability, 2024, 16, 9555
DOI: 10.3390/su16219555

Applications of machine learning in surfaces and interfaces

Shaofeng Xu, Jingyuan Wu, Ying Guo, Qing Zhang, Xiaoxia Zhong, Jinjin Li and Wei Ren

Chemical Physics Reviews, 2025, 6
DOI: 10.1063/5.0244175

Recent progress in photocatalytic NAD(P)H regeneration for photocatalytic-enzymatic-coupling system

Wei Lan, Maodi Wang, Huicong Dai and Qihua Yang

Front. Chem. Sci. Eng., 2024, 18
DOI: 10.1007/s11705-024-2398-0

Machine learning analysis to interpret the effect of the photocatalytic reaction rate constant (k) of semiconductor-based photocatalysts on dye removal

Chang-Min Kim, Zeeshan Haider Jaffari, Ather Abbas, Mir Ferdous Chowdhury and Kyung Hwa Cho

Journal of Hazardous Materials, 2024, 465, 132995
DOI: 10.1016/j.jhazmat.2023.132995

Photo‐Assisted Lithium–Oxygen Batteries: Mechanisms, Materials, and Perspectives

Jing Li, Patrick Sanglier, Hongtao Qu, Zhonghao Miao, Yu Li and Bao‐Lian Su

Advanced Materials, 2026, 38
DOI: 10.1002/adma.202518355

Predictive Modeling of Photocatalytic Hydrogen Production: Integrating Experimental Insights with Machine Learning on Fe/g-C3N4 Catalysts

Bahriyenur Arabacı, Rezan Bakır, Ceren Orak and Aslı Yüksel

Ind. Eng. Chem. Res., 2025, 64, 5184
DOI: 10.1021/acs.iecr.4c03919

From green routes to digital design: Two-dimensional photocatalysts at the interface of machine learning and environmental applications

Rupak Kumar Patnaik and Sujit Sen

Journal of Environmental Chemical Engineering, 2026, 14, 122174
DOI: 10.1016/j.jece.2026.122174

Photothermal-driven enhancing photocatalysis and photoelectrocatalysis: Advances and perspectives

Wenfeng Li, Guocheng Lv, Meng Liu, Fanyue Zhao, Pengfei Shuai, Yanmei Feng, Daimei Chen and Libing Liao

Journal of Energy Chemistry, 2025, 108, 332
DOI: 10.1016/j.jechem.2025.04.027

Paradox in Visible‐Light: O2•‒ Generation by CsPbBr3 Perovskite Nanocrystals

Pravat Nayek, Lipika Bardhan and Prasenjit Mal

Small, 2026
DOI: 10.1002/smll.202511891

Research progress of machine learning in the field of photocatalysis applications

Kun Li, Haoyuan Du, Lei Liu, Hang Yang, Junfei Fang and Dong Li

Journal of Industrial and Engineering Chemistry, 2025, 151, 146
DOI: 10.1016/j.jiec.2025.04.039

Current state of the art and future perspectives for photocatalytic CO2 reduction

Pınar Özdemir and Ramazan Yıldırım

Journal of Energy Chemistry, 2026, 116, 914
DOI: 10.1016/j.jechem.2026.01.055

Influence of synthesis parameters on BiOBr: Taguchi-assisted defect and morphology control for enhanced photocatalytic activity

Raúl Olivera-Flores, Susana Citlaly Gaucin Gutiérrez, Claramaría Rodríguez González, Goldie Oza and Srinivas Godavarthi

Ceramics International, 2026
DOI: 10.1016/j.ceramint.2026.03.277

Engineering of Graphitic Carbon Nitride (g‐C3N4) Based Photocatalysts for Atmospheric Protection: Modification Strategies, Recent Progress, and Application Challenges

Tao Zhong, Wenbin Huang, Zhangnan Yao, Xianhu Long, Wei Qu, Huinan Zhao, Shuanghong Tian, Dong Shu and Chun He

Small, 2024, 20
DOI: 10.1002/smll.202404696

MatGPT: A Vane of Materials Informatics from Past, Present, to Future

Zhilong Wang, An Chen, Kehao Tao, Yanqiang Han and Jinjin Li

Advanced Materials, 2024, 36
DOI: 10.1002/adma.202306733

Machine learning-enhanced photocatalysis for environmental sustainability: Integration and applications

Augustine Jaison, Anandhu Mohan and Young-Chul Lee

Materials Science and Engineering: R: Reports, 2024, 161, 100880
DOI: 10.1016/j.mser.2024.100880