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Derechos | Preview | Fecha Public. | Título | Autor(es) | Tipo |
openAccess | | 2017 | Charge-transfer states and optical transitions at the pentacene-TiO2 interface | Ljungberg, Mathias P.; Vänskä, O.; Koval, Peter CSIC ORCID; Koch, S. W.; Kira, M.; Sánchez-Portal, Daniel CSIC ORCID | artículo |
openAccess | | 2015 | Computation of electron energy loss spectra by an iterative method | Koval, Peter CSIC ORCID; Ljungberg, Mathias P.; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID | artículo |
openAccess | | 2015 | Cubic-scaling iterative solution of the Bethe-Salpeter equation for finite systems | Ljungberg, Mathias P.; Koval, Peter CSIC ORCID; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID | artículo |
closedAccess | | 2017 | Efficient G0W0 using localized basis sets: a benchmark for molecules | Koval, Peter CSIC ORCID; Ljungberg, Mathias P.; Sánchez-Portal, Daniel CSIC ORCID | comunicación de congreso |
openAccess | | 15-oct-2022 | Electrical control of spin-polarized topological currents in monolayer WTe2 | Garcia, Jose H. CSIC ORCID; You, Jinxuan; García-Mota, Mónica; Koval, Peter CSIC ORCID; Ordejón, Pablo CSIC ORCID; Cuadrado, Ramón CSIC ORCID; Verstraete, Matthieu J. CSIC ORCID; Zanolli, Zeila CSIC ORCID; Roche, Stephan CSIC ORCID | carta |
openAccess | | 2014 | Fully self-consistent GW and quasiparticle self-consistent GW for molecules | Koval, Peter CSIC ORCID; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID | artículo |
openAccess | | 2021 | GW approximation for open-shell molecules: a first-principles study | Mansouri, Masoud; Casanova, David CSIC ORCID; Koval, Peter CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID | artículo |
openAccess | | 2023 | Molecular doping in the organic semiconductor diindenoperylene: Insights from many-body perturbation theory | Mansouri, Masoud; Koval, Peter CSIC ORCID; Sharifzadeh, Sahar; Sánchez-Portal, Daniel CSIC ORCID | artículo |
closedAccess | | 2018 | Nanoplasmonics driven by single-atom rearrangements | Koval, Peter CSIC ORCID; Marchesin, Federico CSIC; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID | comunicación de congreso |
closedAccess | | 2017 | Nanoplasmonics from large-scale ab initio calculations: opposite trends in Ag and Na clusters | Barbry, Marc CSIC ORCID; Koval, Peter CSIC ORCID; Koval, Natalia E. CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID | comunicación de congreso |
openAccess | | 2022 | On-surface synthesis of Mn-phthalocyanines with optically active ligands | Domínguez-Celorrio, Amelia CSIC ORCID; García-Fernández, Carlos CSIC ORCID; Quiroga, Sabela; Koval, Peter CSIC ORCID; Langlais, Véronique; Peña, Diego; Sánchez-Portal, Daniel CSIC ORCID ; Serrate, David CSIC ORCID ; Lobo-Checa, Jorge CSIC ORCID | artículo |
closedAccess | | 2016 | Optical response of metal nanojunctions driven by single-atom motion: influence of quantized electron transport on nanoplasmonics | Sánchez-Portal, Daniel CSIC ORCID ; Marchesin, Federico CSIC; Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID | comunicación de congreso |
openAccess | | 2016 | Optical response of silver clusters and their hollow shells from linear-response TDDFT | Koval, Peter CSIC ORCID; Marchesin, Federico CSIC; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID | artículo |
closedAccess | | 2016 | Optical spectroscopy of metallic icosahedral nanoparticles: classical versus atomistic description | Urbieta, Mattin CSIC; Zhang, Yao CSIC ORCID; Barbry, Marc CSIC ORCID; Koval, Peter CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID ; Zabala, Nerea CSIC ORCID; Aizpurua, Javier CSIC ORCID | póster de congreso |
openAccess | | 2016 | Optical spectroscopy of metallic nanoparticles: classical versus quantun description | Urbieta, Mattin CSIC; Barbry, Marc CSIC ORCID; Zhang, Yao CSIC ORCID; Koval, Peter CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID ; Zabala, Nerea CSIC ORCID; Aizpurua, Javier CSIC ORCID | comunicación de congreso |
openAccess | | 2016 | Plasmonic response of metallic nanojunctions driven by single atom motion: Quantum transport revealed in optics | Marchesin, Federico CSIC; Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID | artículo |
closedAccess | | 2016 | Plasmonic response of metallic nanojunctions driven by single atom motion: quantum transport revealed in optics | Marchesin, Federico CSIC; Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID | póster de congreso |
openAccess | | 28-ene-2019 | PySCF-NAO: an efficient and flexible implementation of linear response time-dependent density functional theory with numerical atomic orbitals | Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID | artículo |
closedAccess | | mar-2019 | PySCF-NAO: an efficient and flexible implementation of linear response time-dependent density functional theory with numerical atomic orbitals | Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID | artículo |
openAccess | | 27-may-2020 | Siesta: Recent developments and applications | García Arribas, Alberto CSIC ORCID; Papior, Nick CSIC ORCID; Akhtar, Arsalan CSIC ORCID; Artacho, Emilio; Blum, Volker; Bosoni, Emanuele; Brandimarte, Pedro CSIC ORCID CVN; Brandbyge, Mads; Cerdá, Jorge I. ; Corsetti, Fabiano; Cuadrado, Ramón CSIC ORCID; Dikan, Vladimir; Ferrer, Jaime CSIC ORCID; Gale, Julian D.; García-Fernández, Pablo; García-Suárez, Víctor M. CSIC ORCID ; García, Sandra; Huhs, Georg; Illera, Sergio CSIC; Korytár, Richard CSIC ORCID; Koval, Peter CSIC ORCID; Lebedeva, Irina CSIC ORCID; Lin, Lin; López-Tarifa, Pablo CSIC ORCID; Mayo, Sara G.; Mohr, Stephan; Ordejón, Pablo CSIC ORCID; Postnikov, Andrei; Pouillon, Yann CSIC ORCID; Pruneda, Miguel CSIC ORCID ; Robles, Roberto CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID ; Soler, Josep M. CSIC ORCID ; Ullah, Rafi; Yu, Victor Wen-zhe; Junquera, Javier | artículo |