Search Results - "Peymanirad, F."
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Exploring the potential of graphene oxide frameworks as anode materials for Na-ion batteries applications: a density functional theory study
Published in Applied physics. A, Materials science & processing (01-05-2024)“…This study explores the potential applications of graphene oxide frameworks (GOFs) in Na-ion batteries using density functional theory calculations. The GOF's…”
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Tuning the electronic properties of reduced bilayer graphene oxide: controllable flat bands and improved conductivity
Published in Physica scripta (01-08-2024)“…Going beyond conventional doping techniques, this work explores the interesting phenomenon of flat bands in single and double layer graphene induced by…”
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Graphene-silicene bilayer: A nanocapacitor with permanent dipole and piezoelectricity effect
Published in Physical review. B, Condensed matter and materials physics (09-10-2015)Get full text
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Thermal activated rotation of graphene flake on graphene
Published in Current opinion in chemical engineering (01-06-2017)“…The self rotation of a graphene flake over graphite is controlled by the size, initial misalignment and temperature. Using both ab initio calculations and…”
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Density functional theory study of molecular pillared graphene for High-Performance Sodium-Ion batteries
Published in Applied surface science (01-10-2024)“…[Display omitted] •This research explores the potential of molecular pillared graphene (MPG) for Na-ion battery anodes using simulations.•DFT calculations…”
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Electronic, dielectric and optical properties of two dimensional and bulk ice: a multi-scale simulation study
Published 01-07-2020“…Physical Review B 101.18 (2020): 184202 The intercalated water into nanopores exhibits anomalous properties such as ultralow dielectric constant.~Multi-scale…”
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