Adsorption properties of the molecule resveratrol on CNT(8,0-10) nanotube: Geometry optimization, molecular structure, spectroscopic (NMR, UV/Vis, excited state), FMO, MEP and HOMO-LUMO investigations

Author:

Sheikhi Masoome,Shahab Siyamak,Khaleghian Mehrnoosh,Hajikolaee Fatemeh Haji,Balakhanava Iryna,Alnajjar Radwan

Publisher

Elsevier BV

Subject

Inorganic Chemistry,Organic Chemistry,Spectroscopy,Analytical Chemistry

Reference31 articles.

1. Mechanical and electrical properties of nanotubes;Bernholc;Annu. Rev. Mater. Res.,2002

2. Investigation of non-covalent association of single-walled carbon nanotube with amylose by molecular dynamics simulation;Xie;Mater. Lett.,2005

3. Solution properties of single-walled carbon nanotubes;Chen;Science,1998

4. Interaction site preference between carbon nanotube and nifedipine: a combined density functional theory and classical molecular dynamics study;Liu;J. Mol. Struct. Theochem,2009

5. ONIOM studies of interaction between single-walled carbon nanotube and gallates derivatives as anticancer agents;Mahani;Nanomed. J.,2017

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