Original Article
Synthesis and Characterization of New Diamine Based on Fluorine
1. Synthesis and Characterization of New Diamine Based on Fluorine

Ali Sadeghinia; Hossein Mighani

Articles in Press, Accepted Manuscript, Available Online from 04 July 2019

Abstract
  Aromatic and aliphatic diamines are key components in polyamides, polyimides, polyurea and polyurethanes. To prepare high performance and well-featured materials, attempts are directed ...  Read More
Original Article
Study of Molecular Interactions in Binary Mixtures of Ethylmethylketone and 2-alkanol by Excess Number of i and j Molecules Around a Central Molecule j (Δnij)
2. Study of Molecular Interactions in Binary Mixtures of Ethylmethylketone and 2-alkanol by Excess Number of i and j Molecules Around a Central Molecule j (Δnij)

Elham Shahbazi; Mohammad Almasi

Articles in Press, Accepted Manuscript, Available Online from 04 July 2019

Abstract
  In order to study the nature, type, and magnitude of interactions in the binary mixtures of methyl-ethyl-ketone and a series of 2-alkanol from 2-propanol up to 2-heptanol, excess (or ...  Read More
Original Article
The Activity of Alkyl Groups in Morpholinium Cation on Chemical Reactivity, and Biological Properties of Morpholinium Tetrafluroborate Ionic Liquid Using the DFT Method
3. The Activity of Alkyl Groups in Morpholinium Cation on Chemical Reactivity, and Biological Properties of Morpholinium Tetrafluroborate Ionic Liquid Using the DFT Method

Mohammad Jahidul Islam; Ajoy Kumer; Sunanda Paul; Md. Nuruzzaman Sarker

Articles in Press, Accepted Manuscript, Available Online from 04 July 2019

Abstract
  The physical properties, chemical and biological properties are evaluated through the Density Functional Theory (DFT) of molecular mechanics. The difference between Highest Occupied ...  Read More
Original Article
The Bis(4-methoxy-2-hydroxybenzophenone) copper(II) Complex Used as a New Precursor for Preparation of CuO Nanoparticles
4. The Bis(4-methoxy-2-hydroxybenzophenone) copper(II) Complex Used as a New Precursor for Preparation of CuO Nanoparticles

Aliakbar Dehno Khalaji; Maryam Ghorbani; Michal Dusek; Vaclav Eigner

Articles in Press, Accepted Manuscript, Available Online from 28 July 2019

Abstract
  In this study, the reaction of 4-methoxy-2-hydroxybenzophenone (HL) with copper(II) nitrate three hydrate in a 1:2 molar ratio in methanol as solvent resulted in the formation of the ...  Read More
Original Article
Permutation Entropy as a Parameter of Characterizing the Surface of a Thin Film
5. Permutation Entropy as a Parameter of Characterizing the Surface of a Thin Film

Mohammad Reza Zamani Meymian

Articles in Press, Accepted Manuscript, Available Online from 05 August 2019

Abstract
  In this work, silver thin films were prepared using sputtering at different deposition times with the nanoscale thickness. To investigate their surface morphology, atomic force microscopy ...  Read More
Original Article
Conformational Analysis of 2-halo-1,3,2-dioxaphosphinanes: A Density Functional Theory (DFT) Investigation
6. Conformational Analysis of 2-halo-1,3,2-dioxaphosphinanes: A Density Functional Theory (DFT) Investigation

Masoumeh Vafaei-Nezhad; Reza Ghiasi; Fatemeh Shafiei

Articles in Press, Accepted Manuscript, Available Online from 15 September 2019

Abstract
  This research aimed at evaluating the stability of the 2-halo-1,3,2-dioxaphosphinanes conformers at the LC-BLYP/aug-cc-pVTZ level of theory. The estimation of the total energy and the ...  Read More
Original Article
Investigation of ACE Inhibitory Effect and Antioxidant Activity of Peptide Extracted from Spirulina Platensis
7. Investigation of ACE Inhibitory Effect and Antioxidant Activity of Peptide Extracted from Spirulina Platensis

Gholamreza Mahdieh; Mohamad Fazilati; Mahdieh Izadi; Aliasghar Pilehvarian; Habibollah Nazem

Articles in Press, Accepted Manuscript, Available Online from 15 September 2019

Abstract
  Spirulina platensis is a green-blue microalgae and a rich source of many nutrients such as protein, vitamins, and minerals. Spirulina contains peptides that have therapeutic and beneficial ...  Read More
Original Article
Assessment of Cr(VI) Biosorption from Aqueous Solution by Artificial Intelligence
8. Assessment of Cr(VI) Biosorption from Aqueous Solution by Artificial Intelligence

Reza Beigzadeh; Seyed Omid Rastegar

Articles in Press, Accepted Manuscript, Available Online from 05 October 2019

Abstract
  This work investigates the efficiency of date palm fiber as a biosorbent to the removal of Cr(VI) from aqueous solution. The effect of four main factors including, the initial pH, initial ...  Read More
Original Article
Investigation of Adsorption of the Nitrosamine Molecule as a Carcinogen Agent on the AlN Nanotubes: A DFT Study
9. Investigation of Adsorption of the Nitrosamine Molecule as a Carcinogen Agent on the AlN Nanotubes: A DFT Study

Batoul Makiabadi; Mohammad Zakarianezhad

Articles in Press, Accepted Manuscript, Available Online from 06 October 2019

Abstract
  In this study, chemical reactivity of (4,0) and (5,0) AlN nanotubes by interaction with nitrosamine molecule as a carcinogen agent was investigated using the B3LYP/6-311++G (d) level ...  Read More