RESEARCH PAPER · Accounts of Chemical Research · 2025
Population Balance Models for Catalytic Depolymerization: From Elementary Steps to Multiphase Reactors
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Enlightening the Depolymerization Kinetic Mechanism in Reversed Atom Transfer Radical Polymerization via In Silico Modeling
Macromolecules · 2025-08-29
Jiang Wang, Tiantian Wang, Chao Bian, Zheng‐Hong Luo, Yin‐Ning Zhou
Read original paper ↗ ·Enhancing selectivity and yield in polyethylene hydrogenolysis using goal-aware Bayesian algorithm execution
Digital Discovery · 2026-01-01
Makenna L. Pennel, Akash Ramdas, Sean Gasiorowski, Sathya R. Chitturi, Willie Neiswanger, Nicholas Broadbent, Mike Dunne, Felipe H. da Jornada, Daniel Ratner, Christopher J. Tassone, Matteo Cargnello
Read original paper ↗ ·Random-Scission Kinetics of Cured Epoxy Resin in Alkaline Sub-CW Based on a Coarse-Grained Network Structure
Industrial & Engineering Chemistry Research · 2026-04-28
Qi Zeng, Xiao-Sa Liu, Zibin Huang, Jingyi Yang, Jian‐Hong Gong, Pei‐Qing Yuan
Read original paper ↗ ·Experimental study and PBM-based numerical simulation of the stability of liquid metal nanofluids
Powder Technology · 2026-06-05
Chaobo Li, Weijie Zhong, Yudong Liu, Zhenyu Lv, Jiayi Liu, Zongheng Zhang
Read original paper ↗ ·Development of a Digital Twin for Anionic Polymerization–The Importance of Reliable Substance Data
ACS Omega · 2026-06-22
Felix Kandelhard, Juliane Schymura, Prokopios Georgopanos
Read original paper ↗ ·Coupled Population Balance Models for Evolution of Alkane, α ‐Olefin, and α, ω ‐Olefin Molecular Weight Distributions During Polypropylene Thermal Pyrolysis
ChemSusChem · 2026-07-21
Jiankai Ge, John B. Russell, Uddhav Kanbur, Magali S. Ferrandon, Massimiliano Delferro, David M. Kaphan, Baron Peters
Read original paper ↗ ·Molecular Insights into Competitive Adsorption in the Deconstruction of Mixed Polyolefin Waste
ACS Catalysis · 2026-09-30
Rajas M. Mehendale, Christine M. Oberhausen, Elisabeth Roberts, Dionisios G. Vlachos
Read original paper ↗ ·Population-Balance Modeling of Oligomer Evolution and Reactor-Configuration Effects in Poly(ethylene terephthalate) Glycolysis
Industrial & Engineering Chemistry Research · 2026-10-11
Shu-Qi Zhang, Xiao-Sa Liu, Fan Ju, Jingyi Yang, Zibin Huang, Pei‐Qing Yuan
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