Molecular origin of drug release by water boiling inside carbon nanotubes from reactive molecular dynamics simulation and DFT perspectives von Ganji, M. Darvish, Mirzaei, Sh, Dalirandeh, Z.

Volltext

Remediation of phenol-contaminated water by pristine and functionalized SWCNTs: Ab initio van der Waals DFT investigation von Moradi, F., Darvish Ganji, M., Sarrafi, Y.

Volltext

DFT/TD-semiempirical study on the structural and electronic properties and absorption spectra of supramolecular fullerene-porphyrine-metalloporphyrine triads based dye-sensitized s... von Rezvani, M., Darvish Ganji, M., Jameh-Bozorghi, S., Niazi, A.

Volltext

Theoretical insight into hydrogen adsorption onto graphene: a first-principles B3LYP-D3 study von Darvish Ganji, M, Hosseini-khah, S. M, Amini-tabar, Z

Volltext

First-principles and Molecular Dynamics simulation studies of functionalization of Au32 golden fullerene with amino acids von Darvish Ganji, M., Tavassoli Larijani, H., Alamol-hoda, R., Mehdizadeh, M.

Volltext

Computational studies on the interactions of glycine amino acid with graphene, h-BN and h-SiC monolayers von Larijani, H Tavassoli, Jahanshahi, M, Ganji, M Darvish, Kiani, M H

Volltext

Density functional theory based treatment of amino acids adsorption on single-walled carbon nanotubes von Ganji, M.D.

Volltext

A numerical study of the Van der Pol model derived by the Caputo–Fabrizio operator von Jafari, H., Ganji, R. M., Ramroodi, N., Salati, S., Ganji, D. D.

Volltext

Trends of amino acid adsorption onto graphene and graphene oxide surfaces: a dispersion corrected DFT study von Tavassoli Larijani, H., Darvish Ganji, M., Jahanshahi, M.

Volltext

Adsorption of H2S molecules on non-carbonic and decorated carbonic graphenes: A van der Waals density functional study von Ganji, M.D., Sharifi, N., Ahangari, M. Ghorbanzadeh

Volltext

Behavior of a single nitrogen molecule on the pentagon at a carbon nanotube tip: a first-principles study von Ganji, M D

Volltext

Lithium absorption on single-walled boron nitride, aluminum nitride, silicon carbide and carbon nanotubes: A first-principles study von Darvish Ganji, M., Dalirandeh, Z., Khorasani, M.

Volltext

Synthesis, spectral and luminescence study, crystal structure determination and DFT calculation of binuclear palladium(II) complexes von Seyfi, S., Alizadeh, R., Darvish Ganji, M., Amani, V.

Volltext

First principles computational investigation on the possibility of Pt-decorated SiC hexagonal sheet as a suitable material for oxygen reduction reaction von Darvish Ganji, M., Agheb, R., Darvish Ganji, H., Ashrafian, S.

Volltext

Doping of carbon nanotubes with aluminum atom to improve Pt adsorption von GANJI, M. D, GHORBANZADEH AHANGARI, M, KHOSRAVI, A

Volltext

Electrospinning preparation and characterization of cadmium oxide nanofibers von Bazargan, A.M., Fateminia, S.M.A., Ganji, M. Esmaeilpour, Bahrevar, M.A.

Volltext

Operational matrices based on the shifted fifth-kind Chebyshev polynomials for solving nonlinear variable order integro-differential equations von Jafari, H., Nemati, S., Ganji, R. M.

Volltext

Carborane-wheeled nanocar moving on graphene/graphyne surfaces: van der Waals corrected density functional theory study von Darvish Ganji, M., Ghorbanzadeh Ahangari, M., Emami, S.M.

Volltext

Structural and electronic properties of metalloporphyrin (MP, M=Fe, Co and Zn) adsorbed on single walled BNNT and SiCNT von Rezvani, M., Darvish Ganji, M., Jameh-Bozorghi, S.

Volltext

A comparative study of structural and electronic properties of formaldehyde molecule on monolayer honeycomb structures based on vdW-DF prospective von Ganji, M.D., Jameh-Bozorgi, S., Rezvani, M.

Volltext