{"id":14,"date":"2023-10-17T20:14:49","date_gmt":"2023-10-17T18:14:49","guid":{"rendered":"http:\/\/members.ifimac.uam.es\/lindazotti\/?page_id=14"},"modified":"2026-02-25T10:39:26","modified_gmt":"2026-02-25T09:39:26","slug":"publications","status":"publish","type":"page","link":"https:\/\/members.ifimac.uam.es\/lindazotti\/publications\/","title":{"rendered":"Publications"},"content":{"rendered":"
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    1. Spin\u2013orbit-coupled quantum transport with optimised Gaussian-type orbital basis sets: Application to molecular junctions and topological materials,<\/strong>
      \nW. Dednam*, E.B. Lombardi, L. A. Zotti, C. Sabater ,
      \nComputational Materials Science, 267<\/strong>, 114611 (2026)\u00a0 DOI: 10.1016\/j.commatsci.2026.114611 [URL<\/a>]<\/li>\n
    2. Electron transport through negatively curved nanographenes,<\/strong>
      \nL. Palomino-Ruiz, J. P Mora-Fuentes, S. Castro-Fernandez, I. R M\u00e1rquez, J. M Cuerva, J. Catal\u00e1n-Toledo, M. Mas-Torrent, N. Crivillers, E. Leary, A. Mill\u00e1n, L. A Zotti*, M Teresa Gonz\u00e1lez*, A. G Campa\u00f1a* ,
      \nNanoscale, 18<\/strong>, 1957-1964 (2026)\u00a0 DOI: 10.1039\/D5NR04033G [      URL<\/a>]<\/li>\n
    3. ” Twisting” the Data. A Universal Machine-Learning Approach to Classify Single-Molecule Curves and Beyond,<\/strong>
      \nC. Rold\u00e1n Pi\u00f1ero*, M. T. Gonzalez, P. Mart\u00ednez Olmos, L. A. Zotti, E. Leary*.
      \nDigital DIscovery 4<\/strong>, 3043 <\/span>(2025)\u00a0 DOI: 10.1039\/D5DD00207A [      URL<\/a>]<\/li>\n
    4. Conductance oscillations in helicene-based junctions,<\/strong>
      \nJ. Garc\u00eda Ingl\u00e9s, C. Rold\u00e1n Pi\u00f1ero, D. Alejandro Moreno Ramos, R. G.\u00a0 Garc\u00eda Uceda, J. M. Cuerva, E. Leary*, D. Miguel \u00c1lvarez and L. A. Zotti* ,
      \nJ. Journal of Physics: Condensed Matter 37<\/strong>, 135301 (2025)\u00a0 DOI 10.1088\/1361-648X\/adaf67 [      URL<\/a>]<\/li>\n
    5. Long\u2010Range Proton Channels Constructed via Hierarchical Peptide Self\u2010Assembly,<\/strong>
      \nS. Censor, J. Vega Martin, O. Silberbush, S. Murali Mohan Reddy, R. Zalk, L. Friedlander, D. G Trabada, J. Mendieta, G. Le Saux, J. I. Mendieta Moreno, L. A. Zotti, J. Ortega Mateo*, N. Ashkenasy*,
      \nAdv. Mater.\u00a0 36<\/strong>, 2409248 (2024)https:\/\/doi.org\/10.1002\/adma.202409248\u00a0 [      URL<\/a>]<\/li>\n
    6. Low\u2010lying LUMO Boosts Conductance in Antiaromatic Dibenzopentalene Versus Aromatic Analogues,<\/strong>
      \nM Schmidt, L Abell\u00e1n Vicente, MT Gonz\u00e1lez, LA Zotti*, B Esser*, E Leary*,
      \nChem. Eur. J.\u00a0 30<\/strong>, e202400935 (2024) https:\/\/doi.org\/10.1002\/chem.202400935 [      URL<\/a>]<\/li>\n
    7. Interrogating the CISS effect in chiral and paramagnetic organic radicals: the impact of the molecular spin over the total spin polarization<\/strong>,
      \nJ.A. De Sousa, P. Mayorga-Burrezo, S. M\u00edguez-Lago, J. Catal\u00e1n-Toledo, R. Ramos-Tom\u00e1s, A. Ortu\u00f1o, L. A. Zotti, J. J. Palacios, A.G. Campa\u00f1a, J. Veciana, N. Crivillers
      \nJ. Mat chem C 12<\/strong>,\u00a0 11550-11560 (2024) https:\/\/doi.org\/10.1039\/D4TC01389A [      URL<\/a>]<\/li>\n
    8. Antiaromatic Non-Alternant Heterocyclic Compounds as Molecular Wires,<\/strong>
      \nE. Leary, C.Rold\u00e1n-Pi\u00f1ero, R. Rico-S\u00e1nchez-Mateos, L. A Zotti*,
      \nJ. Mat chem C 12<\/strong>, 4306-4315 (2024) https:\/\/doi.org\/10.1039\/D3TC04266A [      URL<\/a>]<\/li>\n
    9. Efficient Electron Hopping Transport through Azurin-Based Junctions,<\/strong>
      \nCarlos Rold\u00e1n-Pi\u00f1ero, Carlos Romero-Mu\u00f1iz, Ismael D\u00edez-P\u00e9rez, J. G. Vilhena, Rub\u00e9n P\u00e9rez, Juan Carlos Cuevas, and Linda A. Zotti*, J. Phys. Chem. Lett. 14<\/strong>, 49, 11242\u201311249 (2023)
      \nhttps:\/\/doi.org\/10.1021\/acs.jpclett.3c02702\u00a0 [      URL<\/a>]<\/li>\n
    10. A group-theoretic approach to the origin of chirality-induced spin selectivity in non-magnetic molecular junctions,<\/strong>
      \nW. Dednam*, M. A. Garc\u00eda-Bl\u00e1zquez, Linda A. Zotti, E. B. Lombardi, C. Sabater, S. Pakdel, and J. J. Palacios, ACS Nano 17<\/span><\/strong>, 7<\/span>, 6452\u20136465<\/span> (2023)
      \nhttps:\/\/doi.org\/10.1021\/acsnano.2c11410\u00a0 [      URL<\/a>]<\/li>\n
    11. Chiral Single\u2010Molecule Potentiometers Based on Stapled ortho\u2010Oligo (phenylene) ethynylenes,<\/strong>
      \nA. Ortu\u00f1o, P. Reine, L. Alvarez de Cienfuegos, I. R. Marquez, W. Dednam, E. B. Lombardi, J. J. Palacios, E. Leary, G. Longhi, V. Mujica, A. Millan, T. Gonzalez*, L. A. Zotti*, D. Miguel*, J. M. Cuerva*, Angew. Chem. Int. Ed. 2023, 62<\/strong>, e202218640; Angew. Chem. 2023, 135, e202218640.
      \nhttps:\/\/doi.org\/10.1002\/anie.202218640 (2023) [      URL<\/a>]<\/li>\n
    12. Experimental Data Confirm Carrier-Cascade Model for Solid-State Conductance across Proteins,<\/strong>
      \nE. Papp, G. Vattay, C. Romero-Mun\u0303iz, L. A Zotti, J. A. Fereiro, M. Sheves, D. Cahen,
      \nJ. Phys. Chem. B 127<\/strong>, 8, 1728\u20131734 (2023) [      URL<\/a>]<\/li>\n
    13. Recent advances in understanding the electron transport through metal-azurin-metal junctions ,<\/strong>
      \nC. Romero-Mu\u00f1iz, J. G. Vilhena , R. Perez , J. C. Cuevas and L. A. Zotti*,
      \nFront. Phys. doi: 10.3389\/fphy.2022.950929 (2022)[      URL<\/a>]<\/li>\n
    14. Adhesion of thin metallic layers on Au surfaces,<\/strong>
      \nLA Zotti, D D O\u2019Regan,
      \nJournal of Physics: Condensed Matter 34 (27), 275001 (2022) [      URL<\/a>]<\/li>\n
    15. Constrained DFT for Molecular Junctions,<\/strong>
      \nLA Zotti, W Dednam, EB Lombardi, JJ Palacios,
      \nNanomaterials 12 (7), 1234 (2022) [      URL<\/a>]<\/li>\n
    16. Three-state molecular potentiometer based on a non-symmetrically positioned in-backbone linker,<\/strong>
      \nPalomino-Ruiz, P Rein\u00e9, I R M\u00e1rquez, L \u00c1lvarez de Cienfuegos, N Agra\u00eft, J M Cuerva, A G Campa\u00f1a, E Leary, D Miguel, A Mill\u00e1n, L A Zotti, M T Gonz\u00e1lez,
      \nJournal of Materials Chemistry C 9 (45), 16282 (2021) [      URL<\/a>]<\/li>\n
    17. The Role of Metal Ions in the Electron Transport through Azurin-Based Junctions,<\/strong>
      \nCarlos Romero-Mu\u00f1iz, Mar\u00eda Ortega, J.G Vilhena, Rub\u00e9n P\u00e9rez, Juan Carlos Cuevas, Linda A. Zotti,
      \nApplied Sciences 11 <\/strong> (9),3732 (2021) [      URL<\/a>]<\/li>\n
    18. Molecular Electronics,<\/strong>
      \nLinda A.Zotti,
      \nApplied Sciences 11 (11), 4828 (2021) [      URL<\/a>]<\/li>\n
    19. Can Electron Transport through a Blue-Copper Azurin Be Coherent? An Ab Initio Study,<\/strong>
      \nCarlos Romero-Mu\u00f1iz, Mar\u00eda Ortega, J.G Vilhena, Ismael D\u00edez-P\u00e9rez, Rub\u00e9n P\u00e9rez, Juan Carlos Cuevas, Linda A. Zotti,
      \nJ. Phys. Chem. C 125 <\/strong> 3, 1693-1702 (2021) (2021) [      URL<\/a>]<\/li>\n
    20. Single-molecule conductance of dibenzopentalenes: antiaromaticity and quantum interference,<\/strong>
      \nMaximilian Schmidt, Daniel Wassy, Mathias Hermann, M Teresa Gonz\u00e1lez, Nicol\u00e1s Agr\u00e4it, Linda A Zotti, Birgit Esser, Edmund Leary,
      \nChemical Communications 57 <\/strong>,745-748 (2021) [      URL<\/a>]<\/li>\n
    21. Backbone charge transport in double-stranded DNA,<\/strong>
      \nRoman Zhuravel, Haichao Huang, Georgia Polycarpou, Savvas Polydorides, Phani Motamarri, Liat Katrivas, Dvir Rotem, Joseph Sperling, Linda A Zotti, Alexander B Kotlyar, Juan Carlos Cuevas, Vikram Gavini, Spiros S Skourtis, Danny Porath,
      \nNature Nanotechnology15 <\/strong>,836\u2013840(2020) [      URL<\/a>]<\/li>\n
    22. Rational design of an unusual 2D-MOF based on Cu (i) and 4-hydroxypyrimidine-5-carbonitrile as linker with conductive capabilities: a theoretical approach based on high-pressure XRD,<\/strong>
      \nAntonio A Garc\u00eda-Valdivia, Francisco J Romero, Javier Cepeda, Diego P Morales, Nicola Casati, Antonio J Mota, Linda A Zotti, Juan J Palacios, Duane Choquesillo-Lazarte, Jos\u00e9 F Salmer\u00f3n, Almudena Rivadeneyra, Antonio Rodr\u00edguez-Di\u00e9guez,
      \nChemical Communications56<\/strong>,9473-9476 (2020)[      URL<\/a>]<\/li>\n
    23. Taming quantum interference in single molecule junctions: induction and resonance are key,<\/strong>
      \nLinda A. Zotti and Edmund Leary,
      \nPhysical Chemistry Chemical Physics, 22<\/strong>,5638-5646 (2020). [      URL<\/a>]<\/li>\n
    24. Tuning Structure and Dynamics of Blue Copper Azurin Junctions via Single Amino-Acid Mutations,<\/strong>
      \nMaria Ortega, JG Vilhena, Linda A Zotti, Ismael D\u00edez-P\u00e9rez, Juan Carlos Cuevas, Rub\u00e9n P\u00e9rez,
      \nBiomolecules, 9<\/strong>,611 (2019). [      URL<\/a>]<\/li>\n
    25. Can one define the conductance of amino acids?,<\/strong>
      \nLinda A Zotti, Beatrice Bednarz, Juan Hurtado-Gallego, Damien Cabosart, Gabino Rubio-Bollinger, Nicolas Agrait, Herre SJ van der Zant,
      \nBiomolecules, 9<\/strong>,580 (2019). [      URL<\/a>]<\/li>\n
    26. Mechanical Deformation and Electronic Structure of a Blue Copper Azurin in a Solid-State Junction,<\/strong>
      \nCarlos Romero-Mu\u00f1iz, Mar\u00eda Ortega, JG Vilhena, Ismael Di\u00e9z-P\u00e9rez, Juan Carlos Cuevas, Rub\u00e9n P\u00e9rez, Linda A Zotti,
      \nBiomolecules, 9<\/strong>,506 (2019). [      URL<\/a>]<\/li>\n
    27. A Solid\u2010State Protein Junction Serves as a Bias\u2010Induced Current Switch,<\/strong>
      \nM. Cahen, D., Fereiro, J.A., Kayser, B., Romero-Mu\u00f1iz, C., Vilan, A., Dolgikh, D.A., Chertkova, R.V., Cuevas, J.C., Zotti, L.A., Pecht, I. and Sheves ,
      \nAngewandte Chemie International Edition, 58<\/strong>,11852-11859 (2019). [      URL<\/a>]<\/li>\n
    28. Doping hepta-alanine with tryptophan: A theoretical study of its effect on the electrical conductance of peptide-based single-molecule junctions,<\/strong>
      \nWerner M Schosser, Linda A Zotti, Juan Carlos Cuevas, Fabian Pauly,
      \nThe Journal of chemical physics, 150<\/strong>,174705 (2019). [      URL<\/a><\/li>\n
    29. The role of oligomeric gold\u2013thiolate units in single-molecule junctions of thiol-anchored molecules,<\/strong>
      \nEdmund Leary, Linda A Zotti, Delia Miguel, Irene R M\u00e1rquez, Luc\u00eda Palomino-Ruiz, Juan Manuel Cuerva, Gabino Rubio-Bollinger, M Teresa Gonz\u00e1lez, Nicol\u00e1s Agrait,
      \nThe Journal of Physical Chemistry C,, 122<\/strong>,3211-3218 (2018). [      URL<\/a>]<\/li>\n
    30. Peltier cooling in molecular junctions,<\/strong>
      \nLongji Cui, Ruijiao Miao, Kun Wang, Dakotah Thompson, Linda Angela Zotti, Juan Carlos Cuevas, Edgar Meyhofer, Pramod Reddy,
      \nNature nanotechnology, 13<\/strong>,122-127 (2018). [      URL<\/a>]<\/li>\n
    31. Ab initio electronic structure calculations of entire blue copper azurins,<\/strong>
      \nCarlos Romero-Muniz, Mar\u00eda Ortega, JG Vilhena, I D\u00edez-P\u00e9rez, Juan Carlos Cuevas, Rub\u00e9n P\u00e9rez, Linda A Zotti,
      \nPhysical Chemistry Chemical Physics, 20<\/strong>,30392-30402 (2018).. [      URL<\/a>]<\/li>\n
    32. Electron transport through homopeptides: Are they really good conductors?,<\/strong>
      \nLinda A Zotti, Juan Carlos Cuevas,
      \nACS Omega, 3<\/strong>,3778-3785 (2018). [      URL<\/a>]<\/li>\n
    33. A simple descriptor for energetics at fcc-bcc metal interfaces,<\/strong>
      \nLinda A. Zotti, Stefano Sanvito, David D. O’Regan,
      \nMaterials & Design, 142<\/strong>,158\u2013165 (2018). [      URL<\/a>]<\/li>\n
    34. Bioengineering a single-protein junction,<\/strong>
      \nMarta P Ruiz, Albert C Aragone\u0300s, Nuria Camarero, JG Vilhena, Maria Ortega, Linda A Zotti, Rube\u0301n Pe\u0301rez, Juan Carlos Cuevas, Pau Gorostiza, Ismael D\u00edez-P\u00e9rez,
      \nJournal of the American Chemical Society, 139<\/strong>,15337-15346 (2017). [      URL<\/a>]<\/li>\n
    35. Platinum atomic contacts: From tunneling to contact,<\/strong>
      \nLinda A Zotti, Rub\u00e9n P\u00e9rez,
      \nPhysical Review B, 95<\/strong>,125438 (2017). [      URL<\/a>]<\/li>\n
    36. Toward multiple conductance pathways with heterocycle-based oligo (phenyleneethynylene) derivatives,<\/strong>
      \nDelia Miguel, Luis Alvarez de Cienfuegos, Ana Mart\u00edn-Lasanta, Sara P Morcillo, Linda A Zotti, Edmund Leary, Marius Bu\u0308rkle, Yoshihiro Asai, Roc\u00edo Jurado, Diego J Ca\u0301rdenas, Gabino Rubio-Bollinger, Nicola\u0301s Agra\u00eft, Juan M Cuerva, M Teresa Gonza\u0301lez,
      \nJournal of the American Chemical Society, 137<\/strong>,13818-13826 (2015). [      URL<\/a>]<\/li>\n
    37. Single-molecule conductance of a chemically modified, \u03c0-extended tetrathiafulvalene and its charge-transfer complex with F4TCNQ,<\/strong>
      \nNazario Mart\u00edn Ra\u00fal Garc\u00eda, M. \u00c1ngeles Herranz, Edmund Leary, M. Teresa Gonz\u00e1lez, Gabino Rubio Bollinger, Marius B\u00fcrkle, Linda A. Zotti, Yoshihiro Asai, Fabian Pauly, Juan Carlos Cuevas, Nicol\u00e1s Agra\u00eft,
      \nBeilstein J.Org.Chem. 11<\/strong>,1068 (2015). . [      URL<\/a>]<\/li>\n
    38. Resonant transport and electrostatic effects in single-molecule electrical junctions,<\/strong>
      \nBrooke, Carly, Andrea Vezzoli, Simon J. Higgins, Linda A. Zotti, J. J. Palacios, and Richard J. Nichols,
      \nPhysical Review B, 91<\/strong>,195438 (2015).[      URL<\/a>]<\/li>\n
    39. Heat dissipation and its relation to thermopower in single-molecule junctions,<\/strong>
      \nLinda A Zotti, Marius B\u00fcrkle, Fabian Pauly, Woochul Lee, Kyeongtae Kim, Wonho Jeong, Yoshihiro Asai, Pramod Reddy, Juan Carlos Cuevas,
      \nNew Journal of Physics, 16<\/strong>,015004 (2014).[      URL<\/a>]<\/li>\n
    40. Heat dissipation in atomic-scale junctions,<\/strong>
      \nWoochul Lee, Kyeongtae Kim, Wonho Jeong, Linda Angela Zotti, Fabian Pauly, Juan Carlos Cuevas, Pramod Reddy,
      \nNature, 498<\/strong>,209 (2013). [      URL<\/a>]<\/li>\n
    41. A Molecular Platinum Cluster Junction: A Single-Molecule Switch,<\/strong>
      \nLinda A Zotti, Edmund Leary, Maria Soriano, Juan Carlos Cuevas, Juan Jose Palacios,
      \nJ. Am. Chem. Soc., 135<\/strong>,2052 (2013). [      URL<\/a>]<\/li>\n
    42. Carbon-fiber tips for scanning probe microscopes and molecular electronics experiments,<\/strong>
      \nGabino Rubio-Bollinger, Andres Castellanos-Gomez, Stefan Bilan, Linda A Zotti, Carlos R Arroyo, Nicol\u00e1s Agra\u00eft, Juan Carlos Cuevas,
      \nNanoscale research letters, 7<\/strong>,1-4 (2012).[      URL<\/a>]<\/li>\n
    43. Ab initio study of the thermopower of biphenyl-based single-molecule junctions,<\/strong>
      \nMarius B\u00fcrkle, Linda A Zotti, Janne K Viljas, David Vonlanthen, Artem Mishchenko, Thomas Wandlowski, Marcel Mayor, Gerd Sch\u00f6n, Fabian Pauly,
      \nPhysical review b, 86<\/strong>,115304 (2012).[      URL<\/a>]<\/li>\n
    44. Theoretical study of the charge transport through C 60-based single-molecule junctions,<\/strong>
      \nStefan Bilan, Linda A Zotti, Fabian Pauly, Juan Carlos Cuevas,
      \nPhysical Review B, 85<\/strong>,205403 (2012). [      URL<\/a>]<\/li>\n
    45. Electronic transport through single noble gas atoms,<\/strong>
      \nLinda A Zotti, Marius B\u00fcrkle, Yannick J Dappe, Fabian Pauly, Juan Carlos Cuevas,
      \nPhysical Review B, 84<\/strong>,193404 (2011). [      URL<\/a>]<\/li>\n
    46. Carbon tips as electrodes for single-molecule junctions,<\/strong>
      \nAndres Castellanos-Gomez, Stefan Bilan, Linda A Zotti, Carlos R Arroyo, Nicol\u00e1s Agra\u00eft, Juan Carlos Cuevas, Gabino Rubio-Bollinger,
      \nApplied Physics Letters, 99<\/strong>,12310 (2011).[      URL<\/a>]<\/li>\n
    47. Single-molecule junctions based on nitrile-terminated biphenyls: a promising new anchoring group,<\/strong>
      \nArtem Mishchenko, Linda A Zotti, David Vonlanthen, Marius Bu\u0308rkle, Fabian Pauly, Juan Carlos Cuevas, Marcel Mayor, Thomas Wandlowski,
      \nJournal of the American Chemical Society, 133<\/strong>,184-187 (2011). [      URL<\/a><\/li>\n
    48. Revealing the role of anchoring groups in the electrical conduction through single\u2010molecule junctions,<\/strong>
      \nLinda A Zotti, Thomas Kirchner, Juan\u2010Carlos Cuevas, Fabian Pauly, Thomas Huhn, Elke Scheer, Artur Erbe,
      \nSmall, 6<\/strong>,1529-1535 (2010).[      URL<\/a>]<\/li>\n
    49. Comment on \u201cChemical versus van der Waals Interaction: The Role of the Heteroatom in the Flat Absorption of Aromatic Molecules C 6 H 6, C 5 NH 5, and C 4 N 2 H 4 on the Cu (110) Surface\u201d,<\/strong>
      \nW Ji, LA Zotti, H-J Gao, WA Hofer,
      \nPhysical review letters,104<\/strong>,099703 (2010).[      URL<\/a>]<\/li>\n
    50. Adsorption of benzene, fluorobenzene and meta\u2010di\u2010fluorobenzene on Cu (110): A computational study,<\/strong>
      \nLA Zotti, G Teobaldi, K Palot\u00e1s, Wei Ji, H\u2010J Gao, WA Hofer,
      \nJournal of computational chemistry, 29<\/strong>,1589-1595 (2008).[      URL<\/a>]<\/li>\n
    51. Dipole-directed assembly of lines of 1, 5-dichloropentane on silicon substrates by displacement of surface charge,<\/strong>
      \nKR Harikumar, Tingbin Lim, IAIN R McNAB, John C Polanyi, Linda Zotti, Serge Ayissi, Werner A Hofer,
      \nNature Nanotechnology, 3<\/strong>,222-228 (2008).[      URL<\/a>]<\/li>\n
    52. Self-assembly of semifluorinated -alkanethiols on {111}-oriented Au investigated with scanning tunneling microscopy experiment and theory,<\/strong>
      \nS N Patole, C J Baddeley, D O\u2019Hagan, NV Richardson, F Zerbetto, LA Zotti, G. Teobaldi, W A Hofer,
      \nJ. Chem. Phys., 127<\/strong>,024702 (2007). [      URL<\/a>]<\/li>\n
    53. Ab-initio calculations and STM observations on tetrapyridyl and Fe (II)-tetrapyridyl-porphyrin molecules on Ag (1 1 1), <\/strong>
      \nLA Zotti, G Teobaldi, WA Hofer, W Auw\u00e4rter, A Weber-Bargioni, JV Barth,
      \nSurface science, 601<\/strong>,2409-2414 (2007).[      URL<\/a>]<\/li>\n
    54. Electron scattering in scanning probe microscopy experiments,<\/strong>
      \nLinda A Zotti, Werner A Hofer, Franz J Giessibl,
      \nChemical physics letters, 420<\/strong>,177-182 (2006). [      URL<\/a>]<\/li>\n
    55. Poly (phenyleneethynylene) polymers bearing glucose substituents as promising active layers in enantioselective chemiresistors,<\/strong>
      \nMC Tanese, L Torsi, N Cioffi, LA Zotti, D Colangiuli, GM Farinola, F Babudri, F Naso, MM Giangregorio, L Sabbatini, PG Zambonin,
      \nSensors and Actuators B: Chemical, 100<\/strong>,17-21 (2004).[      URL<\/a>]<\/li>\n<\/ol>\n<\/li>\n
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                    Spin\u2013orbit-coupled quantum transport with optimised Gaussian-type orbital basis sets: Application to molecular junctions and topological materials, W. Dednam*, E.B. Lombardi, L. A. Zotti, C. Sabater , Computational Materials Science, 267, 114611 (2026)\u00a0 DOI: 10.1016\/j.commatsci.2026.114611 [URL] Electron transport through negatively curved nanographenes, L. Palomino-Ruiz, J. P Mora-Fuentes, S. Castro-Fernandez, I. R M\u00e1rquez, J. M Cuerva, J.…<\/p>\n","protected":false},"author":1,"featured_media":0,"parent":0,"menu_order":0,"comment_status":"closed","ping_status":"closed","template":"","meta":{"_mo_disable_npp":"","footnotes":""},"class_list":["post-14","page","type-page","status-publish","hentry","no-post-thumbnail","entry"],"_links":{"self":[{"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/pages\/14","targetHints":{"allow":["GET"]}}],"collection":[{"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/pages"}],"about":[{"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/types\/page"}],"author":[{"embeddable":true,"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/users\/1"}],"replies":[{"embeddable":true,"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/comments?post=14"}],"version-history":[{"count":34,"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/pages\/14\/revisions"}],"predecessor-version":[{"id":274,"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/pages\/14\/revisions\/274"}],"wp:attachment":[{"href":"https:\/\/members.ifimac.uam.es\/lindazotti\/wp-json\/wp\/v2\/media?parent=14"}],"curies":[{"name":"wp","href":"https:\/\/api.w.org\/{rel}","templated":true}]}}