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Emul, Y., Erbahar, D. & Acikgoz, M. (2015) Investigation of the Fe3+ centers in perovskite KMgF3 through a combination of ab initio (density functional theory) and semi-empirical (superposition model) calculations. J. Appl. Phys. 118 063903.   
Last edited by: Richard Baschera 2021-04-27 12:42:53 Pop. 1.25%
Emul, Y., Erbahar, D. & Acikgoz, M. (2014) Analysis of the local structure around Cr3+ centers in perovskite KMgF3 using both ab initio (DFT) and semi-empirical (SPM) calculations. Chem. Phys. 444 52–60.   
Added by: Laurent Cournède 2016-03-10 21:01:54 Pop. 0.75%
Ewels, C. P., Erbahar, D., Wagner, P., Rocquefelte, X., Arenal, R., Pochet, P., Rayson, M., Scardamaglia, M., Bittencourt, C. & Briddon, P. (2014) Nitrogen segregation in nanocarbons. Faraday Discuss. 173 215–232.   
Added by: Florent Boucher 2016-04-29 09:26:45 Pop. 0.75%
Oberg, S., Adjizian, J. .-J., Erbahar, D., Rio, J., Humbert, B., Dossot, M., Soldatov, A., Lefrant, S., Mevellec, J. .-Y., Briddon, P., Rayson, M. J. & Ewels, C. P. (2016) Effect of functionalization and charging on resonance energy and radial breathing modes of metallic carbon nanotubes. Phys. Rev. B, 93 045408.   
Added by: Laurent Cournède 2016-03-10 18:36:43 Pop. 1%
Rio, J., Erbahar, D., Rayson, M., Briddon, P. & Ewels, C. P. (2016) Cyclotetrahalo-p-phenylenes: simulations of halogen substituted cycloparaphenylenes and their interaction with C-60. Phys. Chem. Chem. Phys. 18 23257–23263.   
Last edited by: Richard Baschera 2016-10-07 09:11:01 Pop. 1.25%
Vuong, A., Trevethan, T., Latham, C. D., Ewels, C. P., Erbahar, D., Briddon, P. R., Rayson, M. J. & Heggie, M. I. (2017) Interlayer vacancy defects in AA-stacked bilayer graphene: density functional theory predictions. J. Phys.-Condes. Matter, 29 155304.   
Last edited by: Richard Baschera 2017-04-28 13:11:27 Pop. 1.25%
wikindx 4.2.2 ©2014 | Références totales : 2856 | Requêtes métadonnées : 49 | Exécution de script : 0.55477 secs | Style : Harvard | Bibliographie : Bibliographie WIKINDX globale