Chi-How Peng
Current Organizations / Institutes
The organizations/institutes from the scholar's latest article
Chi-How Peng has a total of 170 co-authors. Here are the top co-authors by number of shared publications:
- Fu-Sheng Wang
Department of Chemistry, University of North Carolina at Chapel Hill, 101 South Road, Chapel Hill, North Carolina 27514, United States
8 shared publications Hung-Hsun Lu
Department of Chemistry, National Tsing Hua University, Hsinchu, 30013, Taiwan
6 shared publications- Xuefeng Fu
Beijing National Laboratory for Molecular Sciences, State Key Lab of Rare Earth Materials Chemistry and Applications, College of Chemistry and Molecular Engineering, Peking University, Beijing, China
4 shared publications Zhenqiang Wu
Beijing National Laboratory for Molecular Sciences
4 shared publicationsAjdar Akber Medjidov
3 shared publications- Chien-Lung Wang
Department of Chemistry National Taiwan University Taipei Taiwan
3 shared publications
Latest Publications
- Open Access
- 6 July 2026
- Published by Wiley in European Journal of Organic Chemistry
- Vol. 29 (30) , e70667
Reversible‐Deactivation Radical Polymerization of Vinyl Acetate Mediated by Ligand Non‐Innocent Organometallic Tralen Complexes
A series of tralen‐based organometallic complexes incorporating zinc(II), calcium(II), and nickel(II) were synthesized and used for controlling the radical polymerization of vinyl acetate (VAc), N ‐vinylpyrrolidone (NVP), acrylonitrile (AN), and methyl acrylate (MA). The resulting polymerizations demonstrated living characteristics, including linear increases in molecular weight with monomer conversion, molecular weight matching the theoretical values, and the formation of block copolymers. The mechanism studies, supported by NMR spectrum, MALDI‐TOF MS data, and chain extension experiments, indicate that the control of polymerization is governed by a degenerative transfer pathway, with the reactive sites at the γ‐carbon of tropone moieties. The control experiment using EDTA to extract the metal ions from the polymer products confirmed that the polymer chain is bound to the ligand rather than the metal center. This establishes tralen as a non‐innocent ligand that participates in the radical deactivation process.
- 6 July 2026
- Published by Wiley in European Journal of Organic Chemistry
- Vol. 29 (30) , e70667
Open AccessReversible‐Deactivation Radical Polymerization of Vinyl Acetate Mediated by Ligand Non‐Innocent Organometallic Tralen Complexes
A series of tralen‐based organometallic complexes incorporating zinc(II), calcium(II), and nickel(II) were synthesized and used for controlling the radical polymerization of vinyl acetate (VAc), N ‐vinylpyrrolidone (NVP), acrylonitrile (AN), and methyl acrylate (MA). The resulting polymerizations demonstrated living characteristics, including linear increases in molecular weight with monomer conversion, molecular weight matching the theoretical values, and the formation of block copolymers. The mechanism studies, supported by NMR spectrum, MALDI‐TOF MS data, and chain extension experiments, indicate that the control of polymerization is governed by a degenerative transfer pathway, with the reactive sites at the γ‐carbon of tropone moieties. The control experiment using EDTA to extract the metal ions from the polymer products confirmed that the polymer chain is bound to the ligand rather than the metal center. This establishes tralen as a non‐innocent ligand that participates in the radical deactivation process.
- 16 June 2026
- Published by Royal Society of Chemistry (RSC) in Polymer Chemistry
- Vol. 17 (27) , 2942-2948
On-demand degradable thiol-maleimide PEG hydrogels as abrasion-free adhesives
We have synthesized on-demand degradable hydrogels that firmly attach to porcine skin and are easily removed by using l -cysteine solution.
- 16 June 2026
- Published by Royal Society of Chemistry (RSC) in Polymer Chemistry
- Vol. 17 (27) , 2942-2948
On-demand degradable thiol-maleimide PEG hydrogels as abrasion-free adhesives
We have synthesized on-demand degradable hydrogels that firmly attach to porcine skin and are easily removed by using l -cysteine solution.
- 29 April 2026
- Published by Royal Society of Chemistry (RSC) in Polymer Chemistry
- Vol. 17 (20) , 2120-2125
A reusable visible light initiation system for radical polymerizations in water
A stable organic molecule, 4-nitrophenylacetylene, is used as a recyclable photo-initiator for the polymerization of aqueous monomers in water under ambient conditions.
- 29 April 2026
- Published by Royal Society of Chemistry (RSC) in Polymer Chemistry
- Vol. 17 (20) , 2120-2125
A reusable visible light initiation system for radical polymerizations in water
A stable organic molecule, 4-nitrophenylacetylene, is used as a recyclable photo-initiator for the polymerization of aqueous monomers in water under ambient conditions.
- 28 July 2025
- Published by Royal Society of Chemistry (RSC) in Polymer Chemistry
- Vol. 16 (34) , 3864-3874
Troponoid-mediated radical polymerization in aqueous medium
A new strategy, troponoid-mediated radical polymerization, has been applied to the radical polymerization of N-vinylpyrrolidone (NVP), 2-hydroxyethyl acrylate (HEA), and N,N-dimethyl acrylamide (DMA) in aqueous media. The observed living characteristics including the linear increase in molecular weight with monomer conversion and the formation of block copolymers demonstrate the effectiveness of troponoids in controlling radical polymerization in water, but the relatively high dispersity (Đ) implied that the polymerization is partially controlled. Tropone (TP) and its derivatives, tropolone (TP-OH), 2-chlorotropolone (TP-Cl), and 2-methoxytropolone (TP-OMe) were employed to optimize the reaction conditions. The versatility of this approach is further highlighted by the synthesis of PDMA-b-PVP and PHEA-b-PVP block copolymers. Mechanistic insights and kinetic parameters were elucidated through NMR analysis, chain extension experiments, UV/Vis spectroscopy, and computational simulation.
- 28 July 2025
- Published by Royal Society of Chemistry (RSC) in Polymer Chemistry
- Vol. 16 (34) , 3864-3874
Troponoid-mediated radical polymerization in aqueous medium
A new strategy, troponoid-mediated radical polymerization, has been applied to the radical polymerization of N-vinylpyrrolidone (NVP), 2-hydroxyethyl acrylate (HEA), and N,N-dimethyl acrylamide (DMA) in aqueous media. The observed living characteristics including the linear increase in molecular weight with monomer conversion and the formation of block copolymers demonstrate the effectiveness of troponoids in controlling radical polymerization in water, but the relatively high dispersity (Đ) implied that the polymerization is partially controlled. Tropone (TP) and its derivatives, tropolone (TP-OH), 2-chlorotropolone (TP-Cl), and 2-methoxytropolone (TP-OMe) were employed to optimize the reaction conditions. The versatility of this approach is further highlighted by the synthesis of PDMA-b-PVP and PHEA-b-PVP block copolymers. Mechanistic insights and kinetic parameters were elucidated through NMR analysis, chain extension experiments, UV/Vis spectroscopy, and computational simulation.
- Open Access
- 24 July 2025
- Published by American Chemical Society (ACS) in ChemRxiv
Directed Message Passing Neural Networks for Accurate Prediction of Polymer-Solvent Interaction Parameters
Accurate prediction of polymer-solvent interactions is essential for applications such as polymer processing, drug delivery, and membrane separations. The Flory-Huggins interaction parameter (χ parameter) serves as a key descriptor for polymer-solvent compatibility; however, its experimental determination is often costly and time-consuming. In this study, we develop a machine learning framework based on Directed Message Passing Neural Networks (D-MPNNs) to predict χ parameters directly from molecular structures, temperature, and volume fraction. Our approach systematically evaluates different feature representations, pooling methods, and empirical equation integrations to optimize prediction accuracy. Among the tested models, D-MPNN-TC, which incorporates both temperature and volume fraction, demonstrates strong predictive performance (MAE = 0.092, RMSE = 0.162, R² = 0.926), outperforming descriptor-based models that rely on precomputed molecular fingerprints and handcrafted chemical features. Additionally, integrating the Flory-Huggins equation into the classification framework enables highly accurate miscibility predictions, with F1 scores of 0.915. Further analysis using t-SNE visualization reveals that D-MPNNs effectively capture key structural features, such as aromaticity and cyclic structures, that influence polymer-solvent interactions. Our findings highlight the advantages of graph-based molecular representations over traditional fingerprinting methods and underscore the importance of volume fraction information in predicting polymer-solvent compatibility. This study provides a scalable and interpretable framework for leveraging machine learning in polymer science, facilitating data-driven solvent selection and polymer design.
- 24 July 2025
- Published by American Chemical Society (ACS) in ChemRxiv
Open AccessDirected Message Passing Neural Networks for Accurate Prediction of Polymer-Solvent Interaction Parameters
Accurate prediction of polymer-solvent interactions is essential for applications such as polymer processing, drug delivery, and membrane separations. The Flory-Huggins interaction parameter (χ parameter) serves as a key descriptor for polymer-solvent compatibility; however, its experimental determination is often costly and time-consuming. In this study, we develop a machine learning framework based on Directed Message Passing Neural Networks (D-MPNNs) to predict χ parameters directly from molecular structures, temperature, and volume fraction. Our approach systematically evaluates different feature representations, pooling methods, and empirical equation integrations to optimize prediction accuracy. Among the tested models, D-MPNN-TC, which incorporates both temperature and volume fraction, demonstrates strong predictive performance (MAE = 0.092, RMSE = 0.162, R² = 0.926), outperforming descriptor-based models that rely on precomputed molecular fingerprints and handcrafted chemical features. Additionally, integrating the Flory-Huggins equation into the classification framework enables highly accurate miscibility predictions, with F1 scores of 0.915. Further analysis using t-SNE visualization reveals that D-MPNNs effectively capture key structural features, such as aromaticity and cyclic structures, that influence polymer-solvent interactions. Our findings highlight the advantages of graph-based molecular representations over traditional fingerprinting methods and underscore the importance of volume fraction information in predicting polymer-solvent compatibility. This study provides a scalable and interpretable framework for leveraging machine learning in polymer science, facilitating data-driven solvent selection and polymer design.
- Open Access
- 4 June 2025
- Published by American Chemical Society (ACS) in Macromolecules
- Vol. 58 (12) , 6178-6189
Troponoid-Mediated Radical Polymerization of Vinyl Monomers
- 4 June 2025
- Published by American Chemical Society (ACS) in Macromolecules
- Vol. 58 (12) , 6178-6189
Open AccessTroponoid-Mediated Radical Polymerization of Vinyl Monomers
- 7 April 2025
- Published by Wiley in Macromolecular Chemistry and Physics
- Vol. 226 (12)
Synthesis of Poly(vinyl acetate)‐Based Block Copolymers for Highly Stretchable Film by Troponoid‐Mediated Radical Emulsion Polymerization
The emulsion polymerization of vinyl acetate (VAc) is carried out in an aqueous medium containing the anionic surfactant of sodium dodecyl sulfate (SDS) and various troponoids, including tropone (TP), tropolone (TP‐OH), 2‐chlorotropolone (TP‐Cl), and 2‐methoxytropolone (TP‐OMe). This method yields stable latexes of PVAc with characteristics of reversible‐deactivation radical polymerization (RDRP), including predictable molecular weight, smooth shifts in the GPC traces, and molecular weight consistent with the theoretical values. Additionally, block copolymers of poly(vinyl acetate)‐block‐poly(methyl acrylate) (PVAc‐b‐PMA) are prepared and exhibited remarkable stretchability, achieving a strain of 1507% when cast into a film. This innovative RDRP technique offers an environmentally friendly approach for generating PVAc‐based block copolymers suitable for advanced materials applications and potential large‐scale production.
- 7 April 2025
- Published by Wiley in Macromolecular Chemistry and Physics
- Vol. 226 (12)
Synthesis of Poly(vinyl acetate)‐Based Block Copolymers for Highly Stretchable Film by Troponoid‐Mediated Radical Emulsion Polymerization
The emulsion polymerization of vinyl acetate (VAc) is carried out in an aqueous medium containing the anionic surfactant of sodium dodecyl sulfate (SDS) and various troponoids, including tropone (TP), tropolone (TP‐OH), 2‐chlorotropolone (TP‐Cl), and 2‐methoxytropolone (TP‐OMe). This method yields stable latexes of PVAc with characteristics of reversible‐deactivation radical polymerization (RDRP), including predictable molecular weight, smooth shifts in the GPC traces, and molecular weight consistent with the theoretical values. Additionally, block copolymers of poly(vinyl acetate)‐block‐poly(methyl acrylate) (PVAc‐b‐PMA) are prepared and exhibited remarkable stretchability, achieving a strain of 1507% when cast into a film. This innovative RDRP technique offers an environmentally friendly approach for generating PVAc‐based block copolymers suitable for advanced materials applications and potential large‐scale production.
- Open Access
- 9 December 2024
- Published by American Chemical Society (ACS) in Macromolecules
- Vol. 58 (1) , 495-506
Reversible-Deactivation Radical Polymerization of Vinyl Monomers Mediated by Schiff Bases
- 9 December 2024
- Published by American Chemical Society (ACS) in Macromolecules
- Vol. 58 (1) , 495-506
Open AccessReversible-Deactivation Radical Polymerization of Vinyl Monomers Mediated by Schiff Bases