Hamdi, A., Dettmann, D., Botello-Méndez, A. R., Pezeshki, A., Skokan, L., Ruediger, A., Fiori, G., Zanolli, Z., & Orgiu, E. (2026). Large Unsaturated Magnetoresistance in Gated MoS2 Flakes. Small, Article e14561. Advance online publication. [DOI]
Reho, R., Botello-Méndez, A. R., & Zanolli, Z. (2026). Proximity-induced superconductivity in PbTe/Pb heterostructures from first principles. Physical Review B, 113(5), Article 054501. [DOI][Portal]
Espino, M. N., Méndez, A. R. B., & Zanolli, Z. (2026). Emerging topology in Bi(trimer)/Ge(111) subsurface from first-principles. JPhys Materials, 9(1), Article 015016. Advance online publication. [DOI][Portal]
Wittemeier, N., Papior, N., Brandbyge, M., Zanolli, Z., & Ordejon, P. (2026). Quantum transport with spin-orbit coupling: New developments in TranSIESTA. Computer Physics Communications, 320, Article 109996. [DOI][Portal]
2025
Wetenschappelijke publicaties
Vonk, K., Wang, Y., Navarro Espino, M., Botello-Méndez, A. R., Zanolli, Z., & Zandvliet, H. J. W. (2025). Formation and properties of the Bi (√3×√3)R30∘ wetting layer on Ge(111). Physical review. B, Condensed matter and materials physics, 112(205422), Article 205422. [DOI]
Cuperus, J., Kole, A., Botello-Méndez, A. R., Zanolli, Z., Vanmaekelbergh, D., & Swart, I. (2025). One dimensional edge localized YSR states in CrCl3 on NbSe2. npj Quantum Materials, 10(1), Article 51. [DOI][Portal]
Vliem, J. F., Cayan, S. A., Reho, R., Botello-Méndez, A. R., Geiregat, P., Zanolli, Z., & Vanmaekelbergh, D. (2025). Role of Surface Bands in the Photogeneration, Cooling, and Recombination of Charge Carriers in Two-Dimensional Bi2Se3. ACS Nano, 19(18), 17261-17272. [DOI][Portal]
Grubisic Cabo, A., Soriano, D., Guimaraes, M., Afanasiev, D., Garcia, J. H., Aguilera, I., Ali, M. N., Bhattacharyya, S., Blanter, Y. M., Bosma, R., Cheng, Z., Dan, Z., Dash, S. P., Medina Dueñas, J., Gibertini, M., Grytsiuk, S., Houmes, M., Isaeva, A., Knekna, C., ... Soriano, D. (2025). Roadmap on Quantum Magnetic Materials. 2D Materials, 12(3), Article 031501. [DOI][Portal]
2024
Wetenschappelijke publicaties
Reho, R., Wittemeier, N., Kole, A. H., Ordejón, P., & Zanolli, Z. (2024). Density functional Bogoliubov-de Gennes theory for superconductors implemented in the SIESTA code. Physical Review B, 110(13), Article 134505. [DOI][Portal]
Reho, R., Botello-Mendez, A. R., Sangalli, D., Verstraete, M. J., & Zanolli, Z. (2024). Excitonic response in transition metal dichalcogenide heterostructures from first principles: Impact of stacking, twisting, and interlayer distance. Physical Review B, 110(3), 1-15. Article 035118. [DOI][Portal]
Moes, J. R., Vliem, J. F., Monteiro Campos de Melo, P., Wigmans, T. C., Botello-Méndez, A. R., Mendes, R. G., Brenk, E. F. V., Swart, I., Licerán, L. M., Stoof, H., Delerue, C., Zanolli, Z., & Vanmaekelbergh, D. (2024). Characterization of the Edge States in Colloidal Bi2Se3 Platelets. Nano Letters, 24(17), 5110–5116. [DOI][Repository]
Farris, R., Hellman, O., Zanolli, Z., Saleta Reig, D., Varghese, S., Ordejón, P., Tielrooij, K. J., & Verstraete, M. J. (2024). Microscopic understanding of the in-plane thermal transport properties of 2H transition metal dichalcogenides. Physical Review B, 109(12), 1-14. Article 125422. [DOI][Repository]
2023
Wetenschappelijke publicaties
Monteiro Campos de Melo, P., de Abreu, J. C., Guster, B., Giantomassi, M., Zanolli, Z., Gonze, X., & Verstraete, M. J. (2023). High-throughput analysis of Fröhlich-type polaron models. npj Computational Materials, 9(1), Article 147. [DOI][Repository]
Zanolli, Z., Malcioglu, O. B., & Charlier, J.-C. (2023). Carbynes connected to polycyclic aromatic hydrocarbons as potential carriers of diffuse interstellar bands. Astronomy & Astrophysics, 675, Article L9. [DOI][Repository]
Besson, C., Stegmann, P., Schnee, M., Zanolli, Z., Achilli, S., Wittemeier, N., Vierck, A., Frielinghaus, R., Kögerler, P., Maultzsch, J., Ordejón, P., Schneider, C. M., Hucht, A., König, J., & Meyer, C. (2023). Independent and coherent transitions between antiferromagnetic states of few-molecule systems. Physical Review B, 107(24), 1-10. Article 245414. [DOI][Repository]
Varghese, S., Mehew, J. D., Block, A., Reig, D. S., Woźniak, P., Farris, R., Zanolli, Z., Ordejón, P., Verstraete, M. J., Van Hulst, N. F., & Tielrooij, K. J. (2023). A pre-time-zero spatiotemporal microscopy technique for the ultrasensitive determination of the thermal diffusivity of thin films. Review of Scientific Instruments, 94(3), 1-10. Article 034903. [DOI][Repository]
Sohier, T., de Melo, P. M. M. C., Zanolli, Z., & Verstraete, M. J. (2023). The impact of valley profile on the mobility and Kerr rotation of transition metal dichalcogenides. 2D Materials, 10(2), Article 025006. [DOI]
2022
Wetenschappelijke publicaties
Garcia, J. H., You, J., García-Mota, M., Koval, P., Ordejón, P., Cuadrado, R., Verstraete, M. J., Zanolli, Z., & Roche, S. (2022). Electrical control of spin-polarized topological currents in monolayer WTe2. Physical Review B, 106(16), Article L161410. [DOI][Repository]
Libbi, F., De Melo, P. M. M. C., Zanolli, Z., Verstraete, M. J., & Marzari, N. (2022). Phonon-Assisted Luminescence in Defect Centers from Many-Body Perturbation Theory. Physical Review Letters, 128(16), Article 167401. [DOI][Repository]
Wittemeier, N., Ordejón, P., & Zanolli, Z. (2022). Tuning the topological band gap of bismuthene with silicon-based substrates. JPhys Materials, 5(3), Article 035002. [DOI][Repository]
Achilli, S., Besson, C., He, X., Ordejón, P., Meyer, C., & Zanolli, Z. (2022). Magnetic properties of coordination clusters with $Mn4$ and $Co4$ antiferromagnetic cores. Physical Chemistry Chemical Physics, 24(6), 3780-3787. [DOI][Repository]
Reig, D. S., Varghese, S., Farris, R., Block, A., Mehew, J. D., Hellman, O., Woźniak, P., Sledzinska, M., Sachat, A. E., Chávez-Ángel, E., Valenzuela, S. O., van Hulst, N. F., Ordejón, P., Zanolli, Z., Torres, C. M. S., Verstraete, M. J., & Tielrooij, K.-J. (2022). Unraveling Heat Transport and Dissipation in Suspended MoSe2 from Bulk to Monolayer. Advanced Materials, 34(10), 1-9. Article 2108352. [DOI][Repository]
Wittemeier, N., Verstraete, M. J., Ordejón, P., & Zanolli, Z. (2022). Interference effects in one-dimensional moiré crystals. Carbon, 186, 416-422. [DOI][Repository]
Pezo, A., Zanolli, Z., Wittemeier, N., Ordejón, P., Fazzio, A., Roche, S., & Garcia, J. H. (2022). Manipulation of spin transport in graphene/transition metal dichalcogenide heterobilayers upon twisting. 2D Materials, 9(1), Article 015008. [DOI]
2021
Wetenschappelijke publicaties
Melo, P., Zanolli, Z., & Verstraete, M. (2021). (Invited) Ab Initio Exciton and Phonon Dynamics in Transition Metal Dichalcogenides. ECS Meeting Abstracts, MA2021-01(12), 598-598. [DOI]
de Melo, P. M. M. C., Zanolli, Z., & Verstraete, M. J. (2021). Optical Signatures of Defect Centers in Transition Metal Dichalcogenide Monolayers. Advanced Quantum Technologies, 4(3), 1-8. Article 2000118. [DOI][Repository]
2020
Wetenschappelijke publicaties
Ronneberger, I., Zanolli, Z., Wuttig, M., & Mazzarello, R. (2020). Changes of Structure and Bonding with Thickness in Chalcogenide Thin Films. Advanced Materials, 32(29), Article 2001033. [DOI][Repository]
2019
Wetenschappelijke publicaties
Singh, S., Zanolli, Z., Amsler, M., Belhadji, B., Sofo, J. O., Verstraete, M. J., & Romero, A. H. (2019). Low-Energy Phases of Bi Monolayer Predicted by Structure Search in Two Dimensions. Journal of Physical Chemistry Letters, 10(23), 7324-7332. [DOI]
Dewandre, A., Verstraete, M. J., Grobert, N., & Zanolli, Z. (2019, Oct 1). Spectroscopic properties of few-layer tin chalcogenides. IOP Publishing. [DOI]
Ersfeld, M., Volmer, F., De Melo, P. M. M. C., De Winter, R., Heithoff, M., Zanolli, Z., Stampfer, C., Verstraete, M. J., & Beschoten, B. (2019). Spin States Protected from Intrinsic Electron-Phonon Coupling Reaching 100 ns Lifetime at Room Temperature in MoSe2. Nano Letters, 19(6), 4083-4090. [DOI]
2018
Wetenschappelijke publicaties
Zanolli, Z., Niu, C., Bihlmayer, G., Mokrousov, Y., Mavropoulos, P., Verstraete, M. J., & Blügel, S. (2018). Hybrid quantum anomalous Hall effect at graphene-oxide interfaces. Physical Review B, 98(15), Article 155404. [DOI]
2017
Wetenschappelijke publicaties
Borghardt, S., Winkler, F., Zanolli, Z., Verstraete, M. J., Barthel, J., Tavabi, A. H., Dunin-Borkowski, R. E., & Kardynal, B. E. (2017). Quantitative Agreement between Electron-Optical Phase Images of WSe2 and Simulations Based on Electrostatic Potentials that Include Bonding Effects. Physical Review Letters, 118(8), Article 086101. [DOI]
Zhao, J. Z., Fan, W., Verstraete, M. J., Zanolli, Z., Fan, J., Yang, X. B., Xu, H., & Tong, S. Y. (2017). Zhao et al. Reply. Physical Review Letters, 118(23), Article 239602. [DOI]
2016
Wetenschappelijke publicaties
Zhao, J. Z., Fan, W., Verstraete, M. J., Zanolli, Z., Fan, J., Yang, X. B., Xu, H., & Tong, S. Y. (2016). Quasi-One-Dimensional Metal-Insulator Transitions in Compound Semiconductor Surfaces. Physical Review Letters, 117(11), Article 116101. [DOI]
Johansson, J., Zanolli, Z., & Dick, K. A. (2016). Polytype Attainability in III-V Semiconductor Nanowires. Crystal Growth and Design, 16(1), 371-379. [DOI]
Zanolli, Z. (2016). Graphene-multiferroic interfaces for spintronics applications. Scientific Reports, 6, Article 31346. [DOI]
2015
Wetenschappelijke publicaties
Ghasemi, M., Zanolli, Z., Stankovski, M., & Johansson, J. (2015). Size- and shape-dependent phase diagram of In-Sb nano-alloys. Nanoscale, 7(41), 17387-17396. [DOI]
2014
Wetenschappelijke publicaties
Zanolli, Z. (2014). Density Functional Perturbation Theory. In Lecture Notes of the 45th IFF Spring School “Computing Solids: Models, ab initio methods and supercomputing” (2014)
Rispens, G., Ziegler, B., Zanolli, Z., Íñiguez, J., Ghosez, P., & Paruch, P. (2014). Erratum: Phase diagram of BiFeO3/LaFeO3 superlattices studied by x-ray diffraction experiments and first-principles calculations (Phys. Rev. B (2014) 90 (104106)). Physical Review B - Condensed Matter and Materials Physics, 90(13), Article 139905. [DOI]
Rispens, G., Ziegler, B., Zanolli, Z., Íñiguez, J., Ghosez, P., & Paruch, P. (2014). Phase diagram of BiFeO3/ LaFeO3 superlattices studied by x-ray diffraction experiments and first-principles calculations. Physical Review B - Condensed Matter and Materials Physics, 90(10), Article 104106. [DOI]
2013
Wetenschappelijke publicaties
Zanolli, Z., Wojdeł, J. C., Íñiguez, J., & Ghosez, P. (2013). Electric control of the magnetization in BiFeO3/LaFeO 3 superlattices. Physical Review B - Condensed Matter and Materials Physics, 88(6), Article 060102. [DOI]
2012
Wetenschappelijke publicaties
Zanolli, Z., & Charlier, J. C. (2012). Single-molecule sensing using carbon nanotubes decorated with magnetic clusters. ACS Nano, 6(12), 10786-10791. [DOI]
2011
Wetenschappelijke publicaties
Zanolli, Z., Leghrib, R., Felten, A., Pireaux, J. J., Llobet, E., & Charlier, J. C. (2011). Gas sensing with au-decorated carbon nanotubes. ACS Nano, 5(6), 4592-4599. [DOI]
Messing, M. E., Wong-Leung, J., Zanolli, Z., Joyce, H. J., Tan, H. H., Gao, Q., Wallenberg, L. R., Johansson, J., & Jagadish, C. (2011). Growth of straight InAs-on-GaAs nanowire heterostructures. Nano Letters, 11(9), 3899-3905. [DOI]
2010
Wetenschappelijke publicaties
Zanolli, Z., Onida, G., & Charlier, J. C. (2010). Quantum spin transport in carbon chains. ACS Nano, 4(9), 5174-5180. [DOI]
Zanolli, Z., & Charlier, J. C. (2010). Spin transport in carbon nanotubes with magnetic vacancy-defects. Physical Review B - Condensed Matter and Materials Physics, 81(16), Article 165406. [DOI]
2009
Wetenschappelijke publicaties
Leghrib, R., Llobet, E., Felten, A., Pireaux, J. J., Zanolli, Z., Charlier, J. C., Suárez, I., & Ewels, C. (2009). NO2 and CO interaction with plasma treated Au-decorated MWCNTs: Detection pathways. Procedia Chemistry, 1(1), 931-934. [DOI]
Charlier, J. C., Arnaud, L., Avilov, I. V., Delgado, M., Demoisson, F., Espinosa, E. H., Ewels, C. P., Felten, A., Guillot, J., Ionescu, R., Leghrib, R., Llobet, E., Mansour, A., Migeon, H. N., Pireaux, J. J., Reniers, F., Suarez-Martinez, I., Watson, G. E., & Zanolli, Z. (2009). Carbon nanotubes randomly decorated with gold clusters: From nano 2hybrid atomic structures to gas sensing prototypes. Nanotechnology, 20(37), Article 375501. [DOI]
Dubois, S. M. M., Zanolli, Z., Declerck, X., & Charlier, J. C. (2009). Electronic properties and quantum transport in Graphene-based nanostructures. European Physical Journal B, 72(1), 1-24. [DOI]
Zanolli, Z., & Charlier, J. C. (2009). Defective carbon nanotubes for single-molecule sensing. Physical Review B - Condensed Matter and Materials Physics, 80(15), Article 155447. [DOI]
2008
Wetenschappelijke publicaties
Terrones, M., Charlier, J. C., Gloter, A., Cruz-Silva, E., Terrés, E., Li, Y. B., Vinu, A., Zanolli, Z., Dominguez, J. M., Terrones, H., Bando, Y., & Golberg, D. (2008). Experimental and Theoretical studies suggesting the possibility of metallic boron nitride edges in porous nanourchins. Nano Letters, 8(4), 1026-1032. [DOI]
2007
Wetenschappelijke publicaties
Wacaser, B. A., Dick, K. A., Zanolli, Z., Gustafsson, A., Deppert, K., & Samuelson, L. (2007). Size-selected compound semiconductor quantum dots by nanoparticle conversion. Nanotechnology, 18(10), Article 105306. [DOI]
Zanolli, Z., Fuchs, F., Furthmüller, J., Von Barth, U., & Bechstedt, F. (2007). Model GW band structure of InAs and GaAs in the wurtzite phase. Physical Review B - Condensed Matter and Materials Physics, 75(24), Article 245121. [DOI]
Zanolli, Z., Pistol, M. E., Fröberg, L. E., & Samuelson, L. (2007). Quantum-confinement effects in InAs-InP core-shell nanowires. Journal of Physics Condensed Matter, 19(29), Article 295219. [DOI]
Zanolli, Z., Wacaser, B. A., Pistol, M. E., Deppert, K., & Samuelson, L. (2007). Core-shell InP-CdS nanowires: Fabrication and study. Journal of Physics Condensed Matter, 19(29), Article 295218. [DOI]
2006
Wetenschappelijke publicaties
Zanolli, Z., Fröberg, L. E., Björk, M. T., Pistol, M. E., & Samuelson, L. (2006). Fabrication, optical characterization and modeling of strained core-shell nanowires. Thin Solid Films, 515(2 SPEC. ISS.), 793-796. [DOI]
2002
Wetenschappelijke publicaties
Scamarcio, G., Spagnolo, V., Troccoli, M., Zanolli, Z., Rizzi, F., Vitiello, M., Marano, D., Sabato, A., Catalano, I. M., Sibilano, M., & Calabrese, P. (2002). State of the art of InP and GaAs quantum cascade lasers. Conference Proceedings-International Conference on Indium Phosphide and Related Materials, 731-734. [DOI]