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20092025
most citedConfined linear carbon chains: A route to bulk carbyne

472 citations

Showing cond-mat.mtrl-sciShow all

7 papers · 1 filter

cond-mat.mtrl-sci2018★ 15 cited

Photocurrent Generation in a Metallic Transition Metal Dichalcogenide

Naveed Mehmood, Hamid Reza Rasouli, Onur Çakıroğlu +1

Light induced current in two-dimensional (2D) layered materials emerges from mechanisms such as photothermoelectric effect, photovoltaic effect or nonlocal hot carrier transport. S…

cond-mat.mtrl-sci2015★ 472 cited

Confined linear carbon chains: A route to bulk carbyne

Lei Shi, Philip Rohringer, Kazu Suenaga +6

The extreme instability and strong chemical activity of carbyne, the infinite sp1 hybridized carbon chain, are responsible for its low possibility to survive in ambient conditions.…

cond-mat.mtrl-sci2013★ 103 cited

Local Reconstructions of Silicene Induced by Adatoms

V. Ongun Özçelik, S. Ciraci

The interaction of silicene with Si, C, H, O, Ti atoms along with H, HO and O molecules are investigated and the induced functionalities thereof are analyzed using firs…

cond-mat.mtrl-sci2012★ 46 cited

Domain formation on oxidized graphene

M. Topsakal, S. Ciraci

Using first-principles calculations within density functional theory we demonstrate that the adsorption of single oxygen atom results in significant electron transfer from graphene…

cond-mat.mtrl-sci2012★ 47 cited

Epitaxial growth mechanisms of graphene and effects of substrates

V. Ongun Özçelik, S. Cahangirov, S. Ciraci

The growth process of single layer graphene with and without substrate is investigated using ab initio, finite temperature molecular dynamic calculations within density functional…

cond-mat.mtrl-sci2009★ 411 cited

The response of mechanical and electronic properties of graphane to the elastic strain

M. Topsakal, S. Cahangirov, S. Ciraci

Based on first-principles calculations, we resent a method to reveal the elastic properties of recently synthesized monolayer hydrocarbon, graphane. The in-plane stiffness and Pois…

cond-mat.mtrl-sci2009★ 123 cited

Magnetization of Graphane by Dehydrogenation

Hasan Sahin, Can Ataca, Salim Ciraci

Each single hydrogen vacancy created at the surface of graphane gives rise to a local unpaired spin. For domains of hydrogen vacancies the situation is, however complex and depends…