Self-energy corrected DFT-NEGF for conductance in molecular junctions: an accurate and efficient implementation for TRANSIESTA package applied to Au electrodes von Fallaque, Joel G, Rodríguez-González, Sandra, Martín, Fernando, Díaz, Cristina

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A simple model to engineer single-molecule conductance of acenes by chemical disubstitution von Fallaque, Joel G, Rodríguez-González, Sandra, Díaz, Cristina, Martín, Fernando

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Engineering the HOMO–LUMO gap of indeno[1,2- b ]fluorene von Casares, Raquel, Martínez-Pinel, Álvaro, Rodríguez-González, Sandra, Márquez, Irene R., Lezama, Luis, González, M. Teresa, Leary, Edmund, Blanco, Víctor, Fallaque, Joel G., Díaz, Cristina, Martín, Fernando, Cuerva, Juan M., Millán, Alba

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Single‐Molecule Conductance of 1,4‐Azaborine Derivatives as Models of BN‐doped PAHs von Palomino‐Ruiz, Lucía, Rodríguez‐González, Sandra, Fallaque, Joel G., Márquez, Irene R., Agraït, Nicolás, Díaz, Cristina, Leary, Edmund, Cuerva, Juan M., Campaña, Araceli G., Martín, Fernando, Millán, Alba, González, M. Teresa

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Single‐Molecule Conductance of 1,4‐Azaborine Derivatives as Models of BN‐doped PAHs von Palomino‐Ruiz, Lucía, Rodríguez‐González, Sandra, Fallaque, Joel G., Márquez, Irene R., Agraït, Nicolás, Díaz, Cristina, Leary, Edmund, Cuerva, Juan M., Campaña, Araceli G., Martín, Fernando, Millán, Alba, González, M. Teresa

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Tailoring single-molecule conductance with structured graphene electrodes von Fallaque, Joel G., Rodríguez-González, Sandra, Díaz, Cristina, Martín, Fernando

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Engineering the HOMOLUMO gap of indeno[1,2-]fluorene von Casares, Raquel, Martnez-Pinel, lvaro, Rodrguez-Gonzlez, Sandra, Mrquez, Irene R, Lezama, Luis, Gonzlez, M. Teresa, Leary, Edmund, Blanco, Vctor, Fallaque, Joel G, Daz, Cristina, Martn, Fernando, Cuerva, Juan M, Milln, Alba

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