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List of works by Saeid Yeganegi

Adsorption of 5-Fluorouracil and Thioguanine drugs into ZIF-1, ZIF-3 and ZIF-6 by simulation methods

scientific article published on 21 December 2018

Computational study of halogen-free Boron based dicationic ionic liquids of [bis-Mim][BMB]2 and [bis-Mim][BScB]2

scientific article published on 13 November 2018

First-principles vdW-DF investigation on the interaction between the oxazepam molecule and C₆₀ fullerene.

scientific article published on 24 January 2013

Hydrogen adsorption capacities of multi-walled boron nitride nanotubes and nanotube arrays: a grand canonical Monte Carlo study.

scientific article published on 8 December 2011

Molecular Dynamics Simulations of Amide Functionalized Imidazolium Bis(trifluoromethanesulfonyl)imide Dicationic Ionic Liquids.

scientific article published on 14 July 2017

Molecular dynamic simulation of dicationic ionic liquids: effects of anions and alkyl chain length on liquid structure and diffusion

scientific article published on 05 September 2012

Multiscale Computational Study on the Adsorption and Separation of CO2 /CH4 and CO2 /H2 on Li+ -Doped Mixed-Ligand Metal-Organic Framework Zn2 (NDC)2 (diPyNI).

scientific article published on 19 October 2016

Phosphonate monoesters as carboxylate-like linkers for metal organic frameworks

scientific article published on 29 November 2011

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