Procarbazine adsorption on the surface of single walled carbon nanotube: DFT studies

by Mohammad Reza Jalali Sarvestani, Roya Ahmadi, Behnam Farhang Rik
Published 2020-10-01

Density Functional Theory Study of the Behavior of Carbon Nano cone, BP Nano cone and CSi Nano cone as Nano Carriers for 5-Fluorouracil Anticancer Drug in Water

by Tahereh sadat Nasiri Moghaddam, Farrokh Roya Nikmaram, Roya Ahmadi
Published 2017-09-01

Investigating the Complexation of a Recently Synthesized Phenothiazine with Different Metals by Density Functional Theory

by Mohammad Reza Jalali Sarvestani, Roya Ahmadi
Published 2017-12-01

Evaluating the Performance of 2,3-dihydro-1H-phenothiazine-4(5aH)-one as an Ionophore in Construction of a Cation Selective Electrode by Density Functional Theory

by Mohammad Reza Jalali Sarvestani, Roya Ahmadi
Published 2018-01-01

. Investigation of Adsorption Enthalpy of Prolin on the Surface of Graphene with and without Si: A DFT Study

by Roya Ahmadi, Mohamad kiya Karimi Raja
Published 2015-09-01

First Princiles Study of the Electron Transport Properties of Buthane-dithiol Nano-Molecular Wire

by Roya Ahmadi, Masoud Darvish Ganji
Published 2014-01-01

Investigation of Chemical Properties in Fullerene Derivatives of Fluoxetine Drug : A DFT Study

by Roya Ahmadi, ; Mahnaz Salmaniha
Published 2014-03-01

The Energetic, Check of Derived Boron Nitride Nano- cage with (HMX) in Different Conditions of Temperature by Density Functional Theory Method

by Mehdi Ezzati, Roya Ahmadi, Tahereh Boroushaki, Elaheh Sadat MirKamali, Behnam Farhang
Published 2018-01-01

The Effect of Glutamine on Conductivity and Energetic Properties in Graphene: A DFT Studies

by Roya Ahmadi, Elaheh Sadat Mirkamali
Published 2014-12-01

Investigation of Chemical Properties in Fullerene Derivatives of Atenolol Drug: A DFT Study

by Nastaran Maddah Zadeh Darini, Roya Ahmadi
Published 2015-09-01

Synthesis, Characterization, and Application of Zr,Ce-TiO2/SiO2 Nanocomposite Thin Film as Visible-light Active Photocatalyst

by Susan Samadi, Roya Ahmadi, Mehdi Kohi
Published 2015-01-01

The Study of Substituent Effect on Osmabenzene Complexes

by Reza Ghiasi, Roya Ahmadi
Published 2014-01-01