TY - EJOU AU - Tohamy, Hebat-Allah S. TI - Greener, Safer Packaging: Carbon Nanotubes/Gelatin-Enhanced Recycled Paper for Fire Retardation with DFT Calculations T2 - Journal of Renewable Materials PY - 2024 VL - 12 IS - 12 SN - 2164-6341 AB - Fire retardant CNTs/WPP/Gel composite papers were fabricated by incorporating bio-based carbon nanotubes (CNTs) recycled from mature beech pinewood sawdust (MB) and cellulosic waste printed paper (WPP) into a gelatin solution (Gel) and allowing the mixture to dry at room temperature. The CNTs within the WPP matrix formed a network, enhancing the mechanical and thermal properties of the resulting CNTs paper sheet. In comparison to pure WPP/Gel, CNTs/WPP/Gel exhibited superior flexibility, mechanical toughness, and notable flame retardancy characteristics. This study provides a unique and practical method for producing flame-retardant CNTs/WPP/Gel sheets, suitable for diverse industrial applications, especially packaging, where used paper materials pose a significant fire risk. Bio-CNT-based fire-resistant packaging offers enhanced safety during transportation and storage. The sheets demonstrated increased strength and stiffness, with optimal mechanical properties achieved at a 20% CNTs loading. Additionally, thermal stability was improved, as confirmed by thermogravimetric analysis (TGA) and differential thermogravimetry (DTG). Flame retardancy tests revealed a rise in LOI (Limiting Oxygen Index) values with increasing CNTs content, indicating the CNTs’ effectiveness in inhibiting combustion. The compatibility of recycled paper, CNTs, and Gel suggests potential applications in industrial fields, capitalizing on the biocompatible and biodegradable nature of cellulose. Density functional theory (DFT) calculations using the B3LYP with the 6-31G(d) basis set were employed to optimize the stability of these compounds and elucidate their chemical interactions. KW - Carbon nanotubes; packaging; cellulosic waste printed paper; flame retardancy; DFT calculations DO - 10.32604/jrm.2024.054977