Molecular nano-I-beam class of materials: options based on configuration, first principles-based optimization and properties

Molecular nano-I-beam class of materials: options based on configuration, first principles-based optimization and properties

Abstract Nanotubes showed merits including high structural strength-to-weight ratio. However, tubes are less favored regarding stiffness and strength. Nano-I-beams are proposed for improved nano-mechanics. Computationally, the study proposes novel molecular designs of I-beam-like shaped structures....

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Bibliographic Details
Main Author: Salah A. M. Elmoselhy
Format: Article
Language:English
Published: Nature Portfolio 2024-09-01
Series:Scientific Reports
Subjects:
Condensed matter physics
Carbon nanostructures
DFT
First principles, Quantum mechanics computations
Electronic properties
Elastic properties
Online Access:https://doi.org/10.1038/s41598-024-67605-6
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https://doi.org/10.1038/s41598-024-67605-6

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