Strain is a key tuning parameter in solid-state systems, but most studies focus on strain fields extending over tens of nanometers or more. Here we investigate the extreme limit of ultra-localized strain in graphene, introduced through bond defects generated by ultralow-energy implantation of noble gas ions. Using molecular dynamics simulations, Raman spectroscopy, and scanning tunneling microscopy, we identify the formation and thermal stability of bond defects that locally stretch only a few C-C bonds without removing or substituting atoms. Tight-binding calculations reveal that such bond defects induce local charge trapping, leading to substantial Fermi-level shifts. Synchrotron-based angle-resolved photoemission spectroscopy directly confirms these predictions: even at modest defect densities (∼1012cm−2), the graphene Fermi level shifts by up to 0.3 eV. This strong effect is remarkable given that it is achieved without altering graphene’s composition, in contrast to conventional impurity doping or vacancy formation. Upon thermal annealing, the electronic structure recovers towards the pristine state, showing that these effects can be tuned and reversed. Our results establish bond defects as a new class of functional disorder in graphene, capable of strongly modifying its electronic properties solely by bond rearrangement.

Electronic effects of localized strain in graphene / Z. Zarkua, R. Smeyers, A. Seliverstov, R. Villarreal, A.S. Lotfy, R. Joris, M. Saad, H. Tsai, S. De Gendt, S. Brems, S. De Feyter, F. Junge, H. Hofsäss, G. Di Santo, L. Petaccia, S. Achilli, E.H. Åhlgren, F.M. Peeters, M.V. Milošević, L. Covaci, L.M.C. Pereira. - In: CARBON. - ISSN 0008-6223. - 251:(2026 Mar 05), pp. 121343.1-121343.12. [10.1016/j.carbon.2026.121343]

Electronic effects of localized strain in graphene

S. Achilli;
2026

Abstract

Strain is a key tuning parameter in solid-state systems, but most studies focus on strain fields extending over tens of nanometers or more. Here we investigate the extreme limit of ultra-localized strain in graphene, introduced through bond defects generated by ultralow-energy implantation of noble gas ions. Using molecular dynamics simulations, Raman spectroscopy, and scanning tunneling microscopy, we identify the formation and thermal stability of bond defects that locally stretch only a few C-C bonds without removing or substituting atoms. Tight-binding calculations reveal that such bond defects induce local charge trapping, leading to substantial Fermi-level shifts. Synchrotron-based angle-resolved photoemission spectroscopy directly confirms these predictions: even at modest defect densities (∼1012cm−2), the graphene Fermi level shifts by up to 0.3 eV. This strong effect is remarkable given that it is achieved without altering graphene’s composition, in contrast to conventional impurity doping or vacancy formation. Upon thermal annealing, the electronic structure recovers towards the pristine state, showing that these effects can be tuned and reversed. Our results establish bond defects as a new class of functional disorder in graphene, capable of strongly modifying its electronic properties solely by bond rearrangement.
Bond defects; Disorder; Doping; Graphene; Localized strain
Settore PHYS-03/A - Fisica sperimentale della materia e applicazioni
Settore PHYS-04/A - Fisica teorica della materia, modelli, metodi matematici e applicazioni
   Convenient Access to Light Sources Open to Innovation, Science and to the World
   CALIPSOplus
   European Commission
   Horizon 2020 Framework Programme - Research and Innovation action
   730872
5-mar-2026
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Utilizza questo identificativo per citare o creare un link a questo documento: https://hdl.handle.net/2434/1245957
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