activity
20152026
most citedA DFT Investigation of the Electronic and Optical Properties of Pentadiamond

49 citations · 137 across the 43 of their papers we have counts for

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Showing 2018Show all

6 papers · 1 filter

cond-mat.mtrl-sci2018★ 2 cited

Mechanical Properties of Protomene: A Molecular Dynamics Investigation

Eliezer F. Oliveira, Pedro A. S. Autreto, Cristiano F. Woellner +1

Recently, a new class of carbon allotrope called protomene was proposed. This new structure is composed of sp2 and sp3 carbon-bonds. Topologically, protomene can be considered as a…

cond-mat.mtrl-sci2018

On the mechanical properties of novamene: a fully atomistic molecular dynamics and DFT investigation

Eliezer F. Oliveira, Pedro A. S. Autreto, Cristiano F. Woellner +1

We have investigated through fully atomistic reactive molecular dynamics and DFT simulations, the mechanical properties and fracture dynamics of novamene, a new 3D carbon allotrope…

cond-mat.mes-hall2018

Structural and Thermal Stability of Graphyne and Graphdiyne Nanoscroll Structures

Daniel Solis, Daiane D. Borges, Cristiano F. Woellner +1

Graphynes and graphdiynes are generic names for families of two-dimensional carbon allotropes, where acetylenic groups connect benzenoid-like hexagonal rings, with the co-existence…

physics.app-ph2018

Mechanical Properties of Ultralow Density Graphene Oxide/Polydimethylsiloxane Foams

Cristiano F. Woellner, Peter S. Owuor, Tong Li +14

Low-density, highly porous graphene/graphene oxide (GO) based-foams have shown high performance in energy absorption applications, even under high compressive deformations. In gene…

cond-mat.mes-hall2018

Differences in the Mechanical Properties of Monolayer and Multilayer WSe2/MoSe2

Y. M. Jaques, P. Manimunda, Y. Nakanishi +7

Transition metal dichalcogenides are 2D structures with remarkable electronic, chemical, optical and mechanical properties. Monolayer and crystal properties of these structures hav…

cond-mat.mes-hall2018

Mechanical Properties of Schwarzites - A Fully Atomistic Reactive Molecular Dynamics Investigation

Cristiano F. Woellner, Tiago Botari, Eric Perim +1

Schwarzites are crystalline, 3D porous structures with stable negative curvature formed of sp2-hybridized carbon atoms. These structures present topologies with tunable porous size…