141 related articles for article (PubMed ID: 34476036)
1. Tuning the Electronic Properties of Graphane via Hydroxylation: An Ab Initio Study.
Buonocore F; Capasso A; Celino M; Lisi N; Pulci O
J Phys Chem C Nanomater Interfaces; 2021 Jul; 125(29):16316-16323. PubMed ID: 34476036
[TBL] [Abstract][Full Text] [Related]
2. An ab initio study of hydroxylated graphane.
Buonocore F; Capasso A; Lisi N
J Chem Phys; 2017 Sep; 147(10):104705. PubMed ID: 28915759
[TBL] [Abstract][Full Text] [Related]
3. A DFT study of halogen atoms adsorbed on graphene layers.
Medeiros PV; Mascarenhas AJ; de Brito Mota F; de Castilho CM
Nanotechnology; 2010 Dec; 21(48):485701. PubMed ID: 21063056
[TBL] [Abstract][Full Text] [Related]
4. Studying the electronic and phononic structure of penta-graphane.
Einollahzadeh H; Fazeli SM; Dariani RS
Sci Technol Adv Mater; 2016; 17(1):610-617. PubMed ID: 27877907
[TBL] [Abstract][Full Text] [Related]
5. The Self-Association of Graphane Is Driven by London Dispersion and Enhanced Orbital Interactions.
Wang C; Mo Y; Wagner JP; Schreiner PR; Jemmis ED; Danovich D; Shaik S
J Chem Theory Comput; 2015 Apr; 11(4):1621-30. PubMed ID: 26574371
[TBL] [Abstract][Full Text] [Related]
6. Extremely long nonradiative relaxation of photoexcited graphane is greatly accelerated by oxidation: time-domain ab initio study.
Nelson TR; Prezhdo OV
J Am Chem Soc; 2013 Mar; 135(9):3702-10. PubMed ID: 23373957
[TBL] [Abstract][Full Text] [Related]
7. Stability, electronic and magnetic properties of embedded triangular graphene nanoflakes.
Dai QQ; Zhu YF; Jiang Q
Phys Chem Chem Phys; 2012 Jan; 14(3):1253-61. PubMed ID: 22134488
[TBL] [Abstract][Full Text] [Related]
8. Me-graphane: tailoring the structural and electronic properties of Me-graphene
Marinho E; da Silva Autreto PA
Phys Chem Chem Phys; 2021 Apr; 23(15):9483-9491. PubMed ID: 33885083
[TBL] [Abstract][Full Text] [Related]
9. Quantum Spin Hall Effect and Tunable Spin Transport in As-Graphane.
Zhang LZ; Zhai F; Jin KH; Cui B; Huang B; Wang Z; Lu JQ; Liu F
Nano Lett; 2017 Jul; 17(7):4359-4364. PubMed ID: 28628330
[TBL] [Abstract][Full Text] [Related]
10. High precision quantum-chemical treatment of adsorption: Benchmarking physisorption of molecular hydrogen on graphane.
Usvyat D
J Chem Phys; 2015 Sep; 143(10):104704. PubMed ID: 26374053
[TBL] [Abstract][Full Text] [Related]
11. Van Der Waals heterogeneous layer-layer carbon nanostructures involving π···H-C-C-H···π···H-C-C-H stacking based on graphene and graphane sheets.
Yuan K; Zhao RS; Zheng JJ; Zheng H; Nagase S; Zhao SD; Liu YZ; Zhao X
J Comput Chem; 2017 Apr; 38(10):730-739. PubMed ID: 28164347
[TBL] [Abstract][Full Text] [Related]
12. Band Gaps and Optical Spectra of Chlorographene, Fluorographene and Graphane from G0W0, GW0 and GW Calculations on Top of PBE and HSE06 Orbitals.
Karlický F; Otyepka M
J Chem Theory Comput; 2013 Sep; 9(9):4155-64. PubMed ID: 26592406
[TBL] [Abstract][Full Text] [Related]
13. Water Adsorption Control by Surface Nanostructures on Graphene-Related Materials by Grand Canonical Monte Carlo Simulations.
Takamatsu H; Ohba T
Langmuir; 2021 Dec; 37(50):14646-14656. PubMed ID: 34865483
[TBL] [Abstract][Full Text] [Related]
14. First-Principles Study of the Optical Dipole Trap for Two-Dimensional Excitons in Graphane.
Katow H; Akashi R; Miyamoto Y; Tsuneyuki S
Phys Rev Lett; 2022 Jul; 129(4):047401. PubMed ID: 35938993
[TBL] [Abstract][Full Text] [Related]
15. Graphene's cousin: the present and future of graphane.
Zhou C; Chen S; Lou J; Wang J; Yang Q; Liu C; Huang D; Zhu T
Nanoscale Res Lett; 2014 Jan; 9(1):26. PubMed ID: 24417937
[TBL] [Abstract][Full Text] [Related]
16. Vacancy clusters in graphane as quantum dots.
Singh AK; Penev ES; Yakobson BI
ACS Nano; 2010 Jun; 4(6):3510-4. PubMed ID: 20465240
[TBL] [Abstract][Full Text] [Related]
17. Hydrogenated graphene and hydrogenated silicene: computational insights.
Nguyen MT; Phong PN; Tuyen ND
Chemphyschem; 2015 Jun; 16(8):1733-8. PubMed ID: 25820304
[TBL] [Abstract][Full Text] [Related]
18. Interaction studies of propylene and butadiene on tricycle graphane nanosheet - A DFT outlook.
Nagarajan V; Bhuvaneswari R; Chandiramouli R
J Mol Graph Model; 2023 Jun; 121():108449. PubMed ID: 36965229
[TBL] [Abstract][Full Text] [Related]
19. A systematic study of electronic structure from graphene to graphane.
Chandrachud P; Pujari BS; Haldar S; Sanyal B; Kanhere DG
J Phys Condens Matter; 2010 Nov; 22(46):465502. PubMed ID: 21403371
[TBL] [Abstract][Full Text] [Related]
20. Graphane versus graphene: a computational investigation of the interaction of nucleobases, aminoacids, heterocycles, small molecules (CO2, H2O, NH3, CH4, H2), metal ions and onium ions.
Umadevi D; Narahari Sastry G
Phys Chem Chem Phys; 2015 Nov; 17(45):30260-9. PubMed ID: 26426336
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]