Bohayra Mortazavi
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Exceptional piezoelectricity, high thermal conductivity and stiffness and promising photocatalysis in two-dimensional MoSi2N4 family confirmed by first-principles
B Mortazavi, B Javvaji, F Shojaei, T Rabczuk, AV Shapeev, X Zhuang
Nano Energy 82, 105716, 2021
Thermal conductivity and tensile response of defective graphene: A molecular dynamics study
B Mortazavi, S Ahzi
Carbon 63, 460-470, 2013
Application of silicene, germanene and stanene for Na or Li ion storage: A theoretical investigation
B Mortazavi, A Dianat, G Cuniberti, T Rabczuk
Electrochimica Acta 213, 865-870, 2016
Ultra high stiffness and thermal conductivity of graphene like C3N
B Mortazavi
Carbon 118, 25-34, 2017
Borophene as an anode material for Ca, Mg, Na or Li ion storage: A first-principle study
B Mortazavi, A Dianat, O Rahaman, G Cuniberti, T Rabczuk
Journal of Power Sources 329, 456-461, 2016
Modeling of two-phase random composite materials by finite element, Mori-Tanaka and strong contrast methods
B Mortazavi, M Baniassadi, J Bardon, S Ahzi
Composites Part B: Engineering 45 (1), 1117–1125, 2013
First-principles investigation of mechanical properties of silicene, germanene and stanene
B Mortazavi, O Rahaman, M Makaremi, A Dianat, G Cuniberti, T Rabczuk
Physica E: Low-dimensional Systems and Nanostructures 87, 228-232, 2017
Interphase effect on the elastic and thermal conductivity response of polymer nanocomposite materials: 3D finite element study
B Mortazavi, J Bardon, S Ahzi
Computational Materials Science 69, 100-106, 2013
First‐Principles Multiscale Modeling of Mechanical Properties in Graphene/Borophene Heterostructures Empowered by Machine‐Learning Interatomic Potentials
B Mortazavi, M Silani, EV Podryabinkin, T Rabczuk, X Zhuang, ...
Advanced Materials 33 (35), 2102807, 2021
Combined molecular dynamics-finite element multiscale modeling of thermal conduction in graphene epoxy nanocomposites
B Mortazavi, O Benzerara, H Meyer, J Bardon, S Ahzi
Carbon 60, 356–365, 2013
Mechanical responses of borophene sheets: a first-principles study
B Mortazavi, O Rahaman, A Dianat, T Rabczuk
Physical Chemistry Chemical Physics 18 (39), 27405-27413, 2016
Exploring phononic properties of two-dimensional materials using machine learning interatomic potentials
B Mortazavi, IS Novikov, EV Podryabinkin, S Roche, T Rabczuk, ...
Applied Materials Today 20, 100685, 2020
Graphene or h-BN paraffin composite structures for the thermal management of Li-ion batteries: A multiscale investigation
B Mortazavi, H Yang, F Mohebbi, G Cuniberti, T Rabczuk
Applied Energy 202, 323-334, 2017
Machine-learning interatomic potentials enable first-principles multiscale modeling of lattice thermal conductivity in graphene/borophene heterostructures
B Mortazavi, EV Podryabinkin, S Roche, T Rabczuk, X Zhuang, ...
Materials Horizons 7, 2359-2367, 2020
Outstanding strength, optical characteristics and thermal conductivity of graphene-like BC3 and BC6N semiconductors
B Mortazavi, M Shahrokhi, M Raeisi, X Zhuang, LFC Pereira, T Rabczuk
Carbon 149, 733-742, 2019
Flat borophene films as anode materials for Mg, Na or Li-ion batteries with ultra high capacities: A first-principles study
B Mortazavi, O Rahaman, S Ahzi, T Rabczuk
Applied Materials Today 8, 60-67, 2017
Thermal conductivity and mechanical properties of nitrogenated holey graphene
B Mortazavi, O Rahaman, T Rabczuk, LFC Pereira
Carbon 106, 1-8, 2016
Investigation of tensile response and thermal conductivity of boron-nitride nanosheets using molecular dynamics simulations
B Mortazavi, Y Rémond
Physica E: Low-dimensional Systems and Nanostructures 44 (9), 1846-1852, 2012
Adsorption of Metallic, Metalloidic, and Nonmetallic Adatoms on Two-Dimensional C3N
M Makaremi, B Mortazavi, CV Singh
The Journal of Physical Chemistry C 121 (34), 18575-18583, 2017
Atomistic modeling of mechanical properties of polycrystalline graphene
B Mortazavi, G Cuniberti
Nanotechnology 25 (21), 215704, 2014
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