Mostrando 10 resultados de: 36
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Journal of Physical Chemistry C(6)
Physical Review B - Condensed Matter and Materials Physics(5)
ACS Nano(3)
Journal of the American Chemical Society(3)
Physica Status Solidi (B) Basic Research(3)
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Ingeniería y operaciones afines(14)
Química física(14)
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scopus(36)
Channeling of charge carrier plasmons in carbon nanotubes
ArticleAbstract: Ab initio calculations of the loss function of potassium-intercalated and electron-loaded bundles ofPalabras claves:Autores:Duncan John Mowbray, Einarsson E., Knupfer M., Kramberger C., Kraus R., Maruyama S., Pichler T., Roth F., Rubio A., Schuster R.Fuentes:googlescopusCombined experimental and ab initio study of the electronic structure of narrow-diameter single-wall carbon nanotubes with predominant (6,4),(6,5) chirality
ArticleAbstract: Narrow diameter tubes and especially (6,5) tubes with a diameter of 0.75 nm are currently one of thePalabras claves:Autores:De Blauwe K., Duncan John Mowbray, Hoffmann P., Kataura H., Miyata Y., Paola A. Ayala, Pichler T., Rubio A., Shiozawa H.Fuentes:googlescopusBimodal supramolecular functionalization of carbon nanotubes triggered by covalent bond formation
ArticleAbstract: Many applications of carbon nanotubes require their chemical functionalization. Both covalent and suPalabras claves:Autores:Leret S., Navío C., Pérez E.M., Pouillon Y., Rubio A., Santiago CasadoFuentes:googlescopusAnomalous insulator-metal transition in boron nitride-graphene hybrid atomic layers
ArticleAbstract: The study of two-dimensional (2D) electronic systems is of great fundamental significance in physicsPalabras claves:Autores:Ajayan P.M., Balicas L., Capaz R.B., Ci L., Duncan John Mowbray, Jariwala D., Kurth S., Louie S.G., Rubio A., Song L., Storr K.Fuentes:googlescopusA combined photoemission and ab initio study of the electronic structure of (6,4)/(6,5) enriched single wall carbon nanotubes
ArticleAbstract: Due to the growing number of applications of small diameter single wall carbon nanotubes (SWCNTs) inPalabras claves:Photoemission spectroscopy, Single wall carbon nanotubesAutores:De Blauwe K., Duncan John Mowbray, Hoffmann P., Kataura H., Miyata Y., Paola A. Ayala, Pichler T., Rubio A., Shiozawa H.Fuentes:googlescopusA molecular dynamics study of water nucleation using the TIP4P/2005 model
ArticleAbstract: Extensive molecular dynamics simulations were conducted using the TIP4P/2005 water model of AbascalPalabras claves:Autores:Alejandro Pérez Paz, Rubio A.Fuentes:googlescopusAdsorption Conformation and Lateral Registry of Cobalt Porphine on Cu(111)
ArticleAbstract: The tetrapyrrole macrocycle of porphine is the common core of all porphyrin molecules, an interestinPalabras claves:Autores:Alejandro Pérez Paz, Allegretti F., Auwärter W., Barth J.V., Deimel P., Ducke J., Duncan D.A., Garnica M., Lee T., Rubio A., Schwarz M., Thakur P.Fuentes:googlescopusDesigning multifunctional chemical sensors using Ni and Cu doped carbon nanotubes
ArticleAbstract: We demonstrate a "bottom up" approach to the computational design of a multifunctional chemical sensPalabras claves:Co, Metal-doping, Nanosensing, nanotubesAutores:Duncan John Mowbray, Jacobsen K.W., Lastra J.M.G., Rubio A., Thygesen K.S.Fuentes:googlescopusGas sensing and thermal transport through carbon-nanotube-based nanodevices
Book PartAbstract: Designing nanoscale devices, such as gas sensors and thermal dissipators, is challenging at multiplePalabras claves:atomic and molecular physicsThermal properties of nanotubesDFT, condensed matterElectronic transport in nanotubes Electronic transport in nanocontacts, Quantum transport processesChemical sensorsDFTAutores:Alejandro Pérez Paz, Duncan John Mowbray, Halonen N., Kónya Z., Kordás K., Kukovecz , Lastra J.M.G., Leroy Y., Mäklin J., Pouillon Y., Rubio A., Tóth G.Fuentes:googlescopusGold and methane: A noble combination for delicate oxidation
ArticleAbstract: The ability to partially oxidize methane at low temperatures and pressures would have important enviPalabras claves:Au n, CH 4, DFT, Heterogeneous catalysis, Nanoparticles, O 2Autores:Cardamone D., Duncan John Mowbray, Migani A., Rubio A., Walther G.Fuentes:googlescopus