Showing results 1 to 20 of 57
next >
| Rights | Preview | Issue Date | Title | Author(s) | Type |
| openAccess |  | 10-Dec-2018 | 2 x 2 Charge Density Wave in single-layer TiTe2 | Guster, Bogdan; Robles, Roberto CSIC ORCID; Pruneda, Miguel CSIC ORCID; Canadell, Enric CSIC ORCID; Ordejón, Pablo CSIC ORCID | artículo |
| openAccess |  | 2002 | Ab initio calculations of the optical properties of 4-Å-diameter single-walled nanotubes | Machón, M.; Reich, Stephanie; Thomsen, C.; Sánchez-Portal, Daniel CSIC ORCID ; Ordejón, Pablo CSIC ORCID | artículo |
| openAccess |  | 2002 | Ab initio local vibrational modes of light impurities in silicon | Pruneda, Miguel CSIC ORCID; Estreicher, S. K.; Junquera, Javier; Ferrer, J.; Ordejón, Pablo CSIC ORCID | artículo |
| closedAccess |  | 2018 | Addressing the environment electrostatic effect on ballistic electron transport in large systems: A QM/MM-NEGF approach | Feliciano, Gustavo T.; Sanz-Navarro, Carlos F. CSIC; Domingues Coutinho-Neto, Mauricio; Ordejón, Pablo CSIC ORCID; Scheicher, Ralph H.; Reily Rocha, Alexandre | artículo |
| closedAccess |  | 2019 | AiidA Workflow for High-throughput computation of formation energy | Akhtar, A.; Ordejón, Pablo CSIC ORCID; Pruneda, Miguel CSIC ORCID | póster de congreso |
| openAccess |  | 2011 | An efficient implementation of a QM–MM method in SIESTA | Sanz-Navarro, Carlos F. CSIC; García Arribas, Alberto CSIC ORCID; Ordejón, Pablo CSIC ORCID | artículo |
| embargoedAccess |  | 24-Feb-2021 | Anion ordering transition and Fermi surface electron–hole instabilities in the (TMTSF)2ClO4 and (TMTSF)2NO3 Bechgaard salts analyzed through the first-principles Lindhard response function | Guster, Bogdan; Pruneda, Miguel CSIC ORCID; Ordejón, Pablo CSIC ORCID; Canadell, Enric CSIC ORCID; Pouget, Jean-Paul | artículo |
| openAccess |  | Jun-2017 | Anisotropic features in the electronic structure of the two-dimensional transition metal trichalcogenide TiS3: electron doping and plasmons | Silva Guillén, José Ángel; Canadell, Enric CSIC ORCID; Ordejón, Pablo CSIC ORCID; Guinea, F. CSIC ORCID; Roldán, Rafael CSIC ORCID | artículo |
| openAccess |  | Sep-2010 | Band selection and disentanglement using maximally localized Wannier functions: the cases of Co impurities in bulk copper and the Cu(111) surface | Korytár, Richard CSIC ORCID; Pruneda, Miguel CSIC ORCID; Junquera, Javier; Ordejón, Pablo CSIC ORCID; Lorente, Nicolás CSIC | artículo |
| closedAccess |  | 2012 | Chemically tunable transport phenomena of functionalized graphene | Leconte, Nicolás; Lherbier, Aurélien; Varchon, F.; Charlier, Jean-Christopher; Palacios, J. J.; Soriano, David CSIC ORCID; Ordejón, Pablo CSIC ORCID; Roche, Stephan CSIC ORCID | comunicación de congreso |
| closedAccess |  | 2018 | Coexistence of distinct 3x3 structural distortions in the charge density wave state in NbSe2 | Guster, Bogdan; Dreher, Paul; Rubio-Verdú, Carmen; Robles, Roberto CSIC ORCID; Zaldívar-Fernández, Javier; Choi, Deung-Jang; Pruneda, Miguel CSIC ORCID; Ordejón, Pablo CSIC ORCID; Silva-Guillén, José Ángel; Pascual, José I.; Ugeda, Miguel M.; Canadell, Enric CSIC ORCID | póster de congreso |
| openAccess |  | 8-May-2019 | Coexistence of elastic Modulations in the charge density wave state of 2H-NbSe2 | Guster, Bogdan; Rubio-Verdú, Carmen; Robles, Roberto CSIC ORCID; Zaldívar, Javier; Dreher, Paul; Alonso Pruneda, José Miguel ; Silva-Guillén, José Ángel; Deung-Jang, Choi; Pascual, José I.; Ugeda, Miguel M.; Ordejón, Pablo CSIC ORCID; Canadell, Enric CSIC ORCID | artículo |
| openAccess |  | 2019 | Computing material properties with SIESTA | Ordejón, Pablo CSIC ORCID | comunicación de congreso |
| closedAccess |  | 2010 | Damaging Graphene with Ozone Treatment: A Chemically Tunable Metal−Insulator Transition | Leconte, Nicolás; Moser, Joel CSIC ORCID; Ordejón, Pablo CSIC ORCID; Tao, Haihua CSIC; Lherbier, Aurélien; Bachtold, Adrian CSIC ORCID; Alzina, Francesc CSIC ORCID; Sotomayor Torres, C. M. CSIC ORCID; Charlier, Jean-Christopher; Roche, Stephan CSIC ORCID | artículo |
| openAccess |  | 2010 | Density-wave instability in α-(BEDT-TTF)2KHg(SCN)4 studied by x-ray diffuse scattering and by first-principles calculations | Ordejón, Pablo CSIC ORCID; Canadell, Enric CSIC ORCID | artículo |
| closedAccess |  | 2014 | Electronic properties of single-layer and multilayer transition metal dichalcogenides MX2 (M = Mo, W and X = S, Se) | Roldán, Rafael CSIC ORCID; Silva-Guillén, José Ángel; López-Sancho, María Pilar CSIC ORCID; Guinea, F. CSIC ORCID; Cappelluti, E. CSIC ORCID; Ordejón, Pablo CSIC ORCID | artículo |
| openAccess |  | 16-Sep-2016 | Electronic structure of 2H-NbSe2 single-layers in the CDW state | Silva-Guillén, José Ángel; Ordejón, Pablo CSIC ORCID; Guinea, F. CSIC ORCID; Canadell, Enric CSIC ORCID | artículo |
| closedAccess | | 2010 | Electronic Transport between Graphene Layers Covalently Connected by Carbon Nanotubes | Novaes, Frederico D. CSIC; Rurali, Riccardo CSIC ORCID; Ordejón, Pablo CSIC ORCID | artículo |
| closedAccess |  | 2012 | Electroresistance Effect in Ferroelectric Tunnel Junctions with Symmetric Electrodes | Bilc, D. I.; Novaes, Frederico D. CSIC; Íñiguez, Jorge CSIC ORCID; Ordejón, Pablo CSIC ORCID; Ghosez, P. | artículo |
| openAccess |  | 16-May-2019 | Evidence for the weak coupling scenario of the Peierls transition in the blue bronze | Guster, Bogdan; Alonso Pruneda, José Miguel ; Ordejón, Pablo CSIC ORCID; Canadell, Enric CSIC ORCID; Pouget, Jean-Paul | artículo |
