Results 111 to 120 of about 2,766 (188)

Experimentally Engineering the Edge Termination of Graphene Nanoribbons

, 2013
The edges of graphene nanoribbons (GNRs) have attracted much interest due to their potentially strong influence on GNR electronic and magnetic properties.
Alex Zettl, Atamny F., Chenggang Tao, Elias D. C., Giannozzi P., Hongjie Dai, Jiao L. Y., Juanjuan Feng, Klein D. J., Klusek Z., Kobayashi Y., Kobayashi Y., Liming Xie, Liying Jiao, Michael F. Crommie, Nakada K., Niimi Y., Oleg V. Yazyev, Pan M., Park C., Qian G.-X., Ritter K. A., Sofo J. O., Soler J. M., Son Y.-W., Steven G. Louie, Tao C., Tersoff J., Troullier N., Vanderbilt D., Varykhalov A., Wassmann T., Wassmann T., Xiaowei Zhang, Xie L., Yang H., Yazyev O. V., Yazyev O. V., Yen-Chia Chen, Zahra Pedramrazi   +39 more
core   +1 more source

Band Gap Engineering in Two-Dimensional Materials by Functionalization: Methylation of Graphene and Graphene Bilayers. [PDF]

ACS Omega, 2023
Mazarei E, Penschke C, Saalfrank P.
europepmc   +1 more source

Vibrational properties of graphene fluoride and graphane

, 2010
The vibrational properties of graphene fluoride and graphane are studied using ab initio calculations. We find that both sp3 bonded derivatives of graphene have different phonon dispersion relations and phonon density of states as expected from the ...
Hernández-Nieves, A. D., Leenaerts, O., Partoens, B., Peelaers, H., Peeters, F. M.   +4 more
core   +1 more source

In Silico Demonstration of Fast Anhydrous Proton Conduction on Graphanol. [PDF]

ACS Appl Mater Interfaces, 2023
Achar SK, Bernasconi L, DeMaio RI, Howard KR, Johnson JK.   +4 more
europepmc   +1 more source

Synthesis of Graphene and Graphene Films with Minimal Structural Defects. [PDF]

ACS Omega, 2023
Tran MH, Booth I, Azarakhshi A, Berrang P, Wulff J, Brolo AG.   +5 more
europepmc   +1 more source

Velocity-Gauge Real-Time Time-Dependent Density Functional Tight-Binding for Large-Scale Condensed Matter Systems. [PDF]

J Chem Theory Comput, 2023
Xu Q, Del Ben M, Sait Okyay M, Choi M, Ibrahim KZ, Wong BM.   +5 more
europepmc   +1 more source

Graphene to Graphane: Novel Electrochemical Conversion

, 2010
A novel electrochemical means to generate atomic hydrogen, simplifying the synthesis and controllability of graphane formation on graphene is presented. High quality, vacuum grown epitaxial graphene (EG) was used as starting material for graphane conversion.
Daniels, Kevin M., Daas, B., Zhang, R., Chowdhury, I., Obe, A., Weidner, J., Williams, C., Sudarshan, T. S., Chandrashekhar, MVS   +8 more
openaire   +2 more sources

Graphene as an Adsorption Template for Studying Double Bond Activation in Catalysis. [PDF]

J Phys Chem C Nanomater Interfaces, 2022
Boix V, Xu W, D'Acunto G, Stubbe J, Gallo T, Døvre Strømsheim M, Zhu S, Scardamaglia M, Shavorskiy A, Reuter K, Andersen M, Knudsen J.   +11 more
europepmc   +1 more source

Thermal Stability and Vibrational Properties of the 6,6,12-Graphyne-Based Isolated Molecules and Two-Dimensional Crystal. [PDF]

Materials (Basel), 2023
Dolina ES, Kulyamin PA, Grekova AA, Kochaev AI, Maslov MM, Katin KP.   +5 more
europepmc   +1 more source

Gap Opening in Double-Sided Highly Hydrogenated Free-Standing Graphene. [PDF]

Nano Lett, 2022
Betti MG, Placidi E, Izzo C, Blundo E, Polimeni A, Sbroscia M, Avila J, Dudin P, Hu K, Ito Y, Prezzi D, Bonacci M, Molinari E, Mariani C.   +13 more
europepmc   +1 more source