dc.creator | Aguiar, Julio C. | |
dc.creator | Quevedo, Carlos R. | |
dc.creator | Gomez, José M. | |
dc.creator | Di Rocco, Hector Omar | |
dc.date.accessioned | 2018-09-04T22:35:42Z | |
dc.date.accessioned | 2018-11-06T11:46:11Z | |
dc.date.available | 2018-09-04T22:35:42Z | |
dc.date.available | 2018-11-06T11:46:11Z | |
dc.date.created | 2018-09-04T22:35:42Z | |
dc.date.issued | 2017-09 | |
dc.identifier | Aguiar, Julio C.; Quevedo, Carlos R.; Gomez, José M.; Di Rocco, Hector Omar; Theoretical Compton profile of diamond, boron nitride and carbon nitride; Elsevier Science; Physica B: Condensed Matter; 521; 9-2017; 361-364 | |
dc.identifier | 0921-4526 | |
dc.identifier | http://hdl.handle.net/11336/58330 | |
dc.identifier | CONICET Digital | |
dc.identifier | CONICET | |
dc.identifier.uri | http://repositorioslatinoamericanos.uchile.cl/handle/2250/1859319 | |
dc.description.abstract | In the present study, we used the generalized gradient approximation method to determine the electron wave functions and theoretical Compton profiles of the following super-hard materials: diamond, boron nitride (h-BN), and carbon nitride in its two known phases: βC3N4 and gC3N4. In the case of diamond and h-BN, we compared our theoretical results with available experimental data. In addition, we used the Compton profile results to determine cohesive energies and found acceptable agreement with previous experiments. | |
dc.language | eng | |
dc.publisher | Elsevier Science | |
dc.relation | info:eu-repo/semantics/altIdentifier/url/https://www.sciencedirect.com/science/article/pii/S0921452617304052 | |
dc.relation | info:eu-repo/semantics/altIdentifier/doi/https://doi.org/10.1016/j.physb.2017.07.016 | |
dc.rights | https://creativecommons.org/licenses/by-nc-sa/2.5/ar/ | |
dc.rights | info:eu-repo/semantics/restrictedAccess | |
dc.subject | BORON NITRIDE AND CARBON NITRIDE | |
dc.subject | COMPTON PROFILE | |
dc.subject | DIAMOND | |
dc.subject | GENERALIZED GRADIENT APPROXIMATION | |
dc.title | Theoretical Compton profile of diamond, boron nitride and carbon nitride | |
dc.type | Artículos de revistas | |
dc.type | Artículos de revistas | |
dc.type | Artículos de revistas | |