Papers recently cited Multiwfn are shown below, the indices are assigned according to publication date. To check full list of previous publications that cited Multiwfn, please click:
1-5000 5001-10000 10001-15000 15001-present

Note that this is just a partial, very incomplete statistics.


18801 Jing Deng, Ling Chen, Xin Zheng, et al., Insight into UV-LED/chlorine/Fe3+ process for reducing ibuprofen and caffeine: Kinetics, mechanism and DBP formation, J. Environ. Chem. Eng., 13, 115113 (2025) https://www.sciencedirect.com/science/article/pii/S2213343724032457

18802 S. F. Alshahateet, R. M. Altarawneh, S. A. Al-Trawneh, et al., Cheminformatics-based design and biomedical applications of a new Hydroxyphenylcalix[4] resorcinarene as anti-cancer agent, Sci. Rep., 14, 30460 (2024) https://www.nature.com/articles/s41598-024-82115-1 (Multiwfn was not properly cited!)

18803 Wei Luo, Detection of silicone rubber content for composite insulators based on terahertz technology, Proceedings Tenth International Conference on Energy Materials and Electrical Engineering (ICEMEE 2024), 13419, 1341920 (2024) https://doi.org/10.1117/12.3050437

18804 Jing Huang, Bingqing Sun, Lei Liu, Dual cations sensing mechanism of a Al3+/Zn2+ sensor: Roles of ESIPT and TICT, Comput. Theor. Chem. (2024) https://www.sciencedirect.com/science/article/pii/S2210271X24005796

18805 Yumiao Zhang, Weiguo Pan, Haijiao Xie, et al., Deep eutectic solvents inspired synthesis of novel bi-component rare earths extractants for neodymium separation, J. Mol. Liq., 418, 126730 (2025) https://www.sciencedirect.com/science/article/pii/S0167732224027910 (Multiwfn was not properly cited!)

18806 Yarui Xiong, Weiyu Teng, Zhiwei Zhao, et al., Effective Control of the Solution Environment in Aqueous Zinc-ion Batteries for Promoting (002)-Textured Zinc Growth by a Bio-Electrolyte Additive, Energy Storage Mater. (2024) https://www.sciencedirect.com/science/article/pii/S2405829724007864 (Multiwfn was not properly cited!)

18807 Junxian Bai, Mengke Zhang, Fangyuan Si, et al., Directional Transport of Photogenerated Electrons to Reduction Sites in Covalent Organic Frameworks by Microenvironment Modulation for CO2 Photoreduction, Adv. Funct. Mater. (2024) https://onlinelibrary.wiley.com/doi/abs/10.1002/adfm.202420218

18808 Jiabao Cao, Guangqi Fan, Changyuan Wang, Baoxin Lu, Self-Assembling Wheat Gluten Peptide Nanoparticles: Pterostilbene Encapsulation and Interaction Mechanism, Food Hydrocoll. (2024) https://www.sciencedirect.com/science/article/pii/S0268005X24012347 (Multiwfn was not properly cited!)

18809 Fuyan Cao, Xinyue Zhao, Xueqi Fu, Yue Jin, Computational insights into exploring the potential effects of environmental contaminants on human health, ResearchSquare (2024) https://www.researchsquare.com/article/rs-5365282/v1

18810 Maria Maqbool, Khurshid Ayub, Controlled tuning of HOMO and LUMO levels in supramolecular nano-Saturn complexes, RSC Adv., 14, 39395 (2024) https://pubs.rsc.org/en/content/articlelanding/2024/ra/d4ra07068b

18811 Mayara da Silva Santos, Robert Medel, Simon Kruse, et al., Direct Spectroscopic Confirmation of the Oxygen-Centered Diradical Character of the Tetraoxidorhenium(VII) Cation [Re(O)4]+, Chemistry-Methods, 4, e202400023 (2024) https://chemistry-europe.onlinelibrary.wiley.com/doi/10.1002/cmtd.202400023

18812 Liang Fu, Zhenping Qu, Lingling Zhou, Yue Ding, Efficient Electroreduction of CO2 to Formate via Simultaneous Tuning of Hydroxyl Group Coverage and Oxygen Vacancy Amount of In2O3, ACS Sustainable Chem. Eng. (2024) https://pubs.acs.org/doi/abs/10.1021/acssuschemeng.4c07825

18813 Ilya D. Deltsov, Dmitry B. Vinogradov, Konstantin A. Monogarov, Leonid L. Fershtat, Azobis(polynitrophenyl-1,2,5-oxadiazoles) as Heat-Resistant Friction-Insensitive Energetic Materials, J. Org. Chem. (2024) https://pubs.acs.org/doi/abs/10.1021/acs.joc.4c02678

18814 Jin-Ting Ye, Feng-Yang Bai, Jia-Qi Yu, Li-Hui Wang, Theoretical Study on Second-Order Nonlinear Optical Responses of Pyrazine-carba-zole Derivatives in Gas, Solution, and Crystal States, J. Phys. Chem. A (2024) https://pubs.acs.org/doi/abs/10.1021/acs.jpca.4c06140

18815 Zhiling Liu, Yonghong Yan, Yufeng Yang, et al., Analogy of C–Pt and C–O Chemical Bonding in the Diatomic CPt and CO, J. Phys. Chem. A (2024) https://pubs.acs.org/doi/abs/10.1021/acs.jpca.4c06252

18816 Hongfeng Gao, Xiongchao Lin, Kun Dang, et al., Oxidative Stabilization Mechanism of Synthesized Pitch-Based Carbon Fiber by Combining In Situ Analysis and Molecular Simulation, Energy Fuels (2024) https://pubs.acs.org/doi/abs/10.1021/acs.energyfuels.4c04345

18817 Kaifang Huang, Lili Duan, John Z.H. Zhang, From Implicit to Explicit: An Interaction-Reorganization Approach to Molecular Solvation Energy, J. Chem. Theory Comput. (2024) https://pubs.acs.org/doi/full/10.1021/acs.jctc.4c01283

18818 Biju Basumatary, Sawako Yada, Shunsuke Oka, et al., Transformation of benzocorrole isomer into pyrrole-containing polycyclic molecules via copper-mediated cleavage and annulation, Org. Chem. Front. (2025) https://pubs.rsc.org/en/content/articlelanding/2025/qo/d4qo02145b/

18819 Wei Cao, Zonghan Zhu, Qinyuan Li, et al., Effect of butanedione oxime, 3-mercapto-2-propanesulfonate, and histidine on growth and magnetic properties of electrodeposited cobalt on copper substrate, J. Mater. Sci., 35, 2268 (2024) https://link.springer.com/article/10.1007/s10854-024-13997-0

18820 Shuo Yang, Zhiwei Shao, Ling N. Jin, et al., Distinct baseline toxicity of volatile organic compounds (VOCs) in gaseous and liquid phases: mixture effects and potential molecular mechanisms, J. Hazard. Mater. (2024) https://www.sciencedirect.com/science/article/pii/S030438942403471X

18821 Wang Haiou, Xu Yang, Sang Weihe, et al., Extractive rectification using DES for benzene-cyclohexane-cyclohexene ternary azeotropic system, J. Chem. Technol. Biotechnol. (2024) https://scijournals.onlinelibrary.wiley.com/doi/abs/10.1002/jctb.7774

18822 Periyasamy Angamuthu Praveen, Thangavel Kanagasekaran, Theoretical studies on photophysical properties of luminescent thienylboranes and their suitability towards organic lasing, Mater. Chem. Phys. (2024) https://www.sciencedirect.com/science/article/pii/S025405842401397X

18823 Xinfang Zhang, Zekun Tong, Shaoqiang Dong, et al., Fluorenyl Radicals Stabilized by Donor-π-Radical Conjugation between Nitrogen Atoms and Carbon Radicals, Chin. J. Chem. (2024) https://onlinelibrary.wiley.com/doi/full/10.1002/cjoc.202401000 (Multiwfn was not properly cited!)

18824 Huanran Miao, Huiqin Yao, Yong Li, et al., Plasma-Induced Construction of S-Scheme Heterojunctions Enables Photo-Enhanced Peroxymonosulfate Activation for Gaseous Toluene Removal, Adv. Energy Mater. (2024) https://onlinelibrary.wiley.com/doi/full/10.1002/aenm.202404621 (Multiwfn was not properly cited!)