S. J. Hashemifar

activity

20102024

most citedAb initio investigation of magnetic ordering in the double perovskite Sr

_{2}

NiWO

_{6}

19 citations · 89 across the 18 of their papers we have counts for

collaborators

Showing 2017Show all

2 papers · 1 filter

cond-mat.mtrl-sci2017★ 14 cited

First-principles study of MoS $_{2}$ and MoSe $_{2}$ nanoclusters in the framework of evolutionary algorithm and density functional theory

Zohre Hashemi, Shohreh Rafiezadeh, Roohollah Hafizi +2

Evolutionary algorithm is combined with full-potential ab-initio calculations to investigate conformational space of (MoS $_{2}$ ) $_{n}$ and (MoSe $_{2}$ ) $_{n}$ (n=1-10) nanoclusters and to i…

physics.atm-clus2017

First-principles insights into ultrashort laser spectroscopy of molecular nitrogen

Mohammad Reza Jangrouei, S. Javad Hashemifar

In this research, we employ accurate time-dependent density functional calculations for ultrashort laser spectroscopy of nitrogen molecule. Laser pulses with different frequencies,…

First-principles study of MoS2​ and MoSe2​ nanoclusters in the framework of evolutionary algorithm and density functional theory

First-principles insights into ultrashort laser spectroscopy of molecular nitrogen

First-principles study of MoS $_{2}$ and MoSe $_{2}$ nanoclusters in the framework of evolutionary algorithm and density functional theory