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DerechosPreviewFecha Public.TítuloAutor(es)Tipo
openAccessAnisotropic_Saiz_Art2020.pdf.jpg8-abr-2020Anisotropic Thermal Conductivity in Few-Layer and Bulk Titanium Trisulphide from First PrinciplesSaiz, Fernan; Carrete, Jesús CSIC ORCID; Rurali, Riccardo CSIC ORCID artículo
openAccessBorophene vs. graphene interfaces.pdf.jpg2020Borophene vs. graphene interfaces: Tuning the electric double layer in ionic liquidsGómez-González, Víctor; Otero-Mato, J. Manuel; Montes-Campos, Hadrián; García-Andrade, Xabier; García-Fuente, Amador CSIC ORCID; Vega, Andrés; Carrete, Jesús CSIC ORCID; Cabeza, Oscar; Gallego, Luis J.; Varela, Luis M.artículo
openAccess13-dic-2023Calculations of the thermal conductivity of KNbO3 from first-principlesCazorla, Claudio CSIC ORCID; Bichelmaier, Sebastian; Escorihuela Sayalero, Carlos CSIC; Íñiguez, Jorge CSIC ORCID; Carrete, Jesús CSIC ORCID; Rurali, Riccardo CSIC ORCIDdataset
openAccessclimanensearch.pdf.jpg2024Clinamen2: Functional-style evolutionary optimization in Python for atomistic structure searchesWanzenböck, Ralf; Buchner, Florian; Kovács, Péter; Madsen, Georg K.H.; Carrete, Jesús CSIC ORCIDartículo
openAccess2024Electron-induced nonmonotonic pressure dependence of the lattice thermal conductivity of θ -TaNKundu, Ashis; Chen, Yani; Yang, Xiaolong; Meng, Fanchen; Carrete, Jesús CSIC ORCID; Kabir, Mukul; Madsen, Georg K.H.; Li, Wuartículo
openAccessmachinehetero.pdf.jpg2024Machine learning boosted ab initio study of the thermal conductivity of Janus PtSTe van der Waals heterostructuresPan, Lijun; Carrete, Jesús CSIC ORCID; Wang, Zhao; Madsen, Georg K.H.artículo
openAccessneuraldiagram.pdf.jpg2023Neural-network force field backed nested sampling: Study of the silicon p-T phase diagramUnglert, Nico; Carrete, Jesús CSIC ORCID; Pártay, Livia B.; Madsen, Georg K.H.artículo
openAccesssupplementaryneural.pdf.jpg2023Neural-network force field backed nested sampling: Study of the silicon p-T phase diagram. Supplementary MaterialUnglert, Nico; Carrete, Jesús CSIC ORCID; Pártay, Livia B.; Madsen, Georg K.H.dataset
openAccessSaiz_NanoscAdv_2020_editorial.pdf.jpg1-nov-2020Optimisation of the thermoelectric efficiency of zirconium trisulphide monolayers through unixial and biaxial strainSaiz, Fernan; Carrete, Jesús CSIC ORCID; Rurali, Riccardo CSIC ORCID artículo
openAccessCarrete_Nanoscale_2019_editorial.pdf.jpg12-ago-2019Phonon transport across crystal-phase interfaces and twin boundaries in semiconducting nanowiresCarrete, Jesús CSIC ORCID; López Suárez, Miquel; Raya Moreno, Martí; Bochkarev, Anton S.; Royo Valls, Miquel; Madsen, Georg K. H.; Cartoixà, Xavier; Mingo, Natalio; Rurali, Riccardo CSIC ORCID artículo
openAccessstrucnanori.pdf.jpg2010Structural, magnetic, and electronic properties of Nin and Fen nanostructures (n=1–4) adsorbed on zigzag graphene nanoribbonsLongo, R. C.; Carrete, Jesús CSIC ORCID; Ferrer, Jaime CSIC ORCID; Gallego, Luis J.artículo
openAccesssupplemental_materialmachine.pdf.jpg2024Supplemental Material: Machine-learning-boosted ab-initio study of the thermal conductivity of Janus PtSTe van der Waals heterostructuresPan, Lijun; Carrete, Jesús CSIC ORCID; Wang, Zhao; Madsen, Georg K.H.dataset
openAccess2024Supplementary Information for Electron-induced nonmonotonic pressure dependence of the lattice thermal conductivity of θ -TaNKundu, Ashis; Chen, Yani; Yang, Xiaolong; Meng, Fanchen; Carrete, Jesús CSIC ORCID; Kabir, Mukul; Madsen, Georg K.H.; Li, Wudataset
openAccess3CSiC.pdf.jpg2024Thermal conductivity reduction in highly-doped cubic SiC by phonon-defect and phonon-electron scatteringPang, Guijian; Meng, Fanchen; Chen, Yani; Katre, Ankita; Carrete, Jesús CSIC ORCID; Dongre, Bonny; Madsen, Georg K.H.; Mingo, Natalio; Li, Wuartículo