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DerechosPreviewFecha Public.TítuloAutor(es)Tipo
openAccesschargeface.pdf.jpg2017Charge-transfer states and optical transitions at the pentacene-TiO2 interfaceLjungberg, Mathias P.; Vänskä, O.; Koval, Peter CSIC ORCID; Koch, S. W.; Kira, M.; Sánchez-Portal, Daniel CSIC ORCID artículo
openAccessiterative method.pdf.jpg2015Computation of electron energy loss spectra by an iterative methodKoval, Peter CSIC ORCID; Ljungberg, Mathias P.; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID artículo
openAccessCubic-scaling.pdf.jpg2015Cubic-scaling iterative solution of the Bethe-Salpeter equation for finite systemsLjungberg, Mathias P.; Koval, Peter CSIC ORCID; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID artículo
closedAccessaccesoRestringido.pdf.jpg2017Efficient G0W0 using localized basis sets: a benchmark for moleculesKoval, Peter CSIC ORCID; Ljungberg, Mathias P.; Sánchez-Portal, Daniel CSIC ORCID comunicación de congreso
openAccessElectrical_control_Garcia.pdf.jpg15-oct-2022Electrical control of spin-polarized topological currents in monolayer WTe2Garcia, 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 ORCIDcarta
openAccessself-consistent GW.pdf.jpg2014Fully self-consistent GW and quasiparticle self-consistent GW for moleculesKoval, Peter CSIC ORCID; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID artículo
openAccessgwstudy.pdf.jpg2021GW approximation for open-shell molecules: a first-principles studyMansouri, Masoud; Casanova, David CSIC ORCID; Koval, Peter CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID artículo
openAccessmolecularperturbation.pdf.jpg2023Molecular doping in the organic semiconductor diindenoperylene: Insights from many-body perturbation theoryMansouri, Masoud; Koval, Peter CSIC ORCID; Sharifzadeh, Sahar; Sánchez-Portal, Daniel CSIC ORCID artículo
closedAccessaccesoRestringido.pdf.jpg2018Nanoplasmonics driven by single-atom rearrangementsKoval, Peter CSIC ORCID; Marchesin, Federico CSIC; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID comunicación de congreso
closedAccessaccesoRestringido.pdf.jpg2017Nanoplasmonics from large-scale ab initio calculations: opposite trends in Ag and Na clustersBarbry, Marc CSIC ORCID; Koval, Peter CSIC ORCID; Koval, Natalia E. CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID comunicación de congreso
openAccessonliga.pdf.jpg2022On-surface synthesis of Mn-phthalocyanines with optically active ligandsDomínguez-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
closedAccessaccesoRestringido.pdf.jpg2016Optical response of metal nanojunctions driven by single-atom motion: influence of quantized electron transport on nanoplasmonicsSánchez-Portal, Daniel CSIC ORCID ; Marchesin, Federico CSIC; Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID comunicación de congreso
openAccessoptirespo.pdf.jpg2016Optical response of silver clusters and their hollow shells from linear-response TDDFTKoval, Peter CSIC ORCID; Marchesin, Federico CSIC; Foerster, D.; Sánchez-Portal, Daniel CSIC ORCID artículo
closedAccessaccesoRestringido.pdf.jpg2016Optical spectroscopy of metallic icosahedral nanoparticles: classical versus atomistic descriptionUrbieta, 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
openAccessCEN16optical.pdf.jpg2016Optical spectroscopy of metallic nanoparticles: classical versus quantun descriptionUrbieta, 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
openAccessRevealed Optics.pdf.jpg2016Plasmonic response of metallic nanojunctions driven by single atom motion: Quantum transport revealed in opticsMarchesin, Federico CSIC; Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID artículo
closedAccessaccesoRestringido.pdf.jpg2016Plasmonic response of metallic nanojunctions driven by single atom motion: quantum transport revealed in opticsMarchesin, Federico CSIC; Koval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Aizpurua, Javier CSIC ORCID ; Sánchez-Portal, Daniel CSIC ORCID póster de congreso
openAccessPySCF-NAO_accepted_version.pdf.jpg28-ene-2019PySCF-NAO: an efficient and flexible implementation of linear response time-dependent density functional theory with numerical atomic orbitalsKoval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID artículo
closedAccessaccesoRestringido.pdf.jpgmar-2019PySCF-NAO: an efficient and flexible implementation of linear response time-dependent density functional theory with numerical atomic orbitalsKoval, Peter CSIC ORCID; Barbry, Marc CSIC ORCID; Sánchez-Portal, Daniel CSIC ORCID artículo
openAccessGarciaArribas_JChemPhys_2020_postprint.pdf.jpg27-may-2020Siesta: Recent developments and applicationsGarcía 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, Javierartículo