Discover the SciOpen Platform and Achieve Your Research Goals with Ease.
Atomic cluster-based networks represent a promising architecture for the realization of neuromorphic computing systems, which may overcome some of the limitations of the current computing paradigm. The formation and breakage of links between the clusters are of utmost importance for the functioning of these computing systems. This paper reports the results of molecular dynamics simulations of synapse (bridge) formation at elevated temperature and thermal breaking processes between 2.8 nm-sized Au1415 clusters deposited on a carbon substrate, a model system. Crucially, we find that the bridge formation process is driven by the diffusion of gold atoms along the substrate, no matter how small the gap between the clusters themselves. The complementary simulations of the bridge breaking process reveal the existence of a threshold bias voltage to activate bridge rupture via Joule heating. These results provide an atomistic-level understanding of the fundamental dynamical processes occurring in neuromorphic cluster arrays.
Waldrop, M. M. The chips are down for Moore’s law. Nature 2016, 530, 144–147.
Nawrocki, R. A.; Voyles, R. M.; Shaheen, S. E. A mini review of neuromorphic architectures and implementations. IEEE Trans. Electron Devices 2016, 63, 3819–3829.
Jaeger, H. Towards a generalized theory comprising digital, neuromorphic and unconventional computing. Neuromorph. Comput. Eng. 2021, 1, 012002.
Bullmore, E.; Sporns, O. The economy of brain network organization. Nat. Rev. Neurosci. 2012, 13, 336–349.
Wang, Z. R.; Wu, H. Q.; Burr, G. W.; Hwang, C. S.; Wang, K. L.; Xia, Q. F.; Yang, J. J. Resistive switching materials for information processing. Nat. Rev. Mater. 2020, 5, 173–195.
Torrejon, J.; Riou, M.; Araujo, F. A.; Tsunegi, S.; Khalsa, G.; Querlioz, D.; Bortolotti, P.; Cros, V.; Yakushiji, K.; Fukushima, A. et al. Neuromorphic computing with nanoscale spintronic oscillators. Nature 2017, 547, 428–431.
Avizienis, A. V.; Sillin, H. O.; Martin-Olmos, C.; Shieh, H. H.; Aono, M.; Stieg, A. Z.; Gimzewski, J. K. Neuromorphic atomic switch networks. PLoS One 2012, 7, e42772.
Ohno, T.; Hasegawa, T.; Tsuruoka, T.; Terabe, K.; Gimzewski, J. K.; Aono, M. Short-term plasticity and long-term potentiation mimicked in single inorganic synapses. Nat. Mater. 2011, 10, 591–595.
Stieg, A. Z.; Avizienis, A. V.; Sillin, H. O.; Martin-Olmos, C.; Aono, M.; Gimzewski, J. K. Emergent criticality in complex turing B-type atomic switch networks. Adv. Mater. 2012, 24, 286–293.
Wuttig, M.; Yamada, N. Phase-change materials for rewriteable data storage. Nat. Mater. 2007, 6, 824–832.
Chua, L. Memristor—The missing circuit element. IEEE Trans. Circuit Theory 1971, 18, 507–519.
Prodromakis, T.; Toumazou, C.; Chua, L. Two centuries of memristors. Nat. Mater. 2012, 11, 478–481.
Mirigliano, M.; Decastri, D.; Pullia, A.; Dellasega, D.; Casu, A.; Falqui, A.; Milani, P. Complex electrical spiking activity in resistive switching nanostructured Au two-terminal devices. Nanotechnology 2020, 31, 234001.
Sattar, A.; Fostner, S.; Brown, S. A. Quantized conductance and switching in percolating nanoparticle films. Phys. Rev. Lett. 2013, 111, 136808.
Mirigliano, M.; Borghi, F.; Podestà, A.; Antidormi, A.; Colombo, L.; Milani, P. Non-ohmic behavior and resistive switching of Au cluster-assembled films beyond the percolation threshold. Nanoscale Adv. 2019, 1, 3119–3130.
Bose, S. K.; Mallinson, J. B.; Gazoni, R. M.; Brown, S. A. Stable self-assembled atomic-switch networks for neuromorphic applications. IEEE Trans. Electron Devices 2017, 64, 5194–5201.
Mallinson, J. B.; Shirai, S.; Acharya, S. K.; Bose, S. K.; Galli, E.; Brown, S. A. Avalanches and criticality in self-organized nanoscale networks. Sci. Adv. 2019, 5, eaaw8483.
Minnai, C.; Mirigliano, M.; Brown, S. A.; Milani, P. The nanocoherer: An electrically and mechanically resettable resistive switching device based on gold clusters assembled on paper. Nano Futures 2018, 2, 011002.
Minnai, C.; Bellacicca, A.; Brown, S. A.; Milani, P. Facile fabrication of complex networks of memristive devices. Sci. Rep. 2017, 7, 7955.
Wegner, K.; Piseri, P.; Tafreshi, H. V.; Milani, P. Cluster beam deposition: A tool for nanoscale science and technology. J. Phys. D:Appl. Phys. 2006, 39, R439.
Zhang, J. J.; Sun, H. J.; Li, Y.; Wang, Q.; Xu, X. H.; Miao, X. S. AgInSbTe memristor with gradual resistance tuning. Appl. Phys. Lett. 2013, 102, 183513.
Palmer, R. E.; Cao, L.; Yin, F. Note: Proof of principle of a new type of cluster beam source with potential for scale-up. Rev. Sci. Instrum. 2016, 87, 046103.
Yang, J. J.; Miao, F.; Pickett, M. D.; Ohlberg, D. A. A.; Stewart, D. R.; Lau, C. N.; Williams, R. S. The mechanism of electroforming of metal oxide memristive switches. Nanotechnology 2009, 20, 215201.
Du, C.; Cai, F. X.; Zidan, M. A.; Ma, W.; Lee, S. H.; Lu, W. D. Reservoir computing using dynamic memristors for temporal information processing. Nat. Commun. 2017, 8, 2204.
Bose, S. K.; Shirai, S.; Mallinson, J. B.; Brown, S. A. Synaptic dynamics in complex self-assembled nanoparticle networks. Faraday Discuss. 2019, 213, 471–485.
Pike, M. D.; Bose, S. K.; Mallinson, J. B.; Acharya, S. K.; Shirai, S.; Galli, E.; Weddell, S. J.; Bones, P. J.; Arnold, M. D.; Brown, S. A. Atomic scale dynamics drive brain-like avalanches in percolating nanostructured networks. Nano Lett. 2020, 20, 3935–3942.
Olsen, M.; Hummelgård, M.; Olin, H. Surface modifications by field induced diffusion. PLoS One 2012, 7, e30106.
Tsong, T. T. Effects of an electric field in atomic manipulations. Phys. Rev. B 1991, 44, 13703–13710.
Mayer, T. M.; Houston, J. E.; Franklin, G. E.; Erchak, A. A.; Michalske, T. A. Electric field induced surface modification of Au. J. Appl. Phys. 1999, 85, 8170–8177.
Convers, P. Y.; McCarthy, D. N.; Sattar, A.; Natali, F.; Hendy, S. C.; Brown, S. A. Electrical signature of nanoscale coalescence in a percolating Bi nanocluster film. Phys. Rev. B 2010, 82, 115409.
Lim, T. H.; McCarthy, D.; Hendy, S. C.; Stevens, K. J.; Brown, S. A.; Tilley, R. D. Real-time TEM and kinetic Monte Carlo studies of the coalescence of decahedral gold nanoparticles. ACS Nano 2009, 3, 3809–3813.
Kuczynski, G. C. Study of the sintering of glass. J. Appl. Phys. 1949, 20, 1160–1163.
Nichols, F. A.; Mullins, W. W. Morphological changes of a surface of revolution due to capillarity-induced surface diffusion. J. Appl. Phys. 1965, 36, 1826–1835.
Kim, T. H.; Zhang, X. G.; Nicholson, D. M.; Evans, B. M.; Kulkarni, N. S.; Radhakrishnan, B.; Kenik, E. A.; Li, A. P. Large discrete resistance jump at grain boundary in copper nanowire. Nano Lett. 2010, 10, 3096–3100.
Johnson, S. L.; Sundararajan, A.; Hunley, D. P.; Strachan, D. R. Memristive switching of single-component metallic nanowires. Nanotechnology 2010, 21, 125204.
Song, T. B.; Chen, Y.; Chung, C. H.; Yang, Y.; Bob, B.; Duan, H. S.; Li, G.; Tu, K. N.; Huang, Y.; Yang, Y. Nanoscale joule heating and electromigration enhanced ripening of silver nanowire contacts. ACS Nano 2014, 8, 2804–2811.
Hoffmann-Vogel, R. Electromigration and the structure of metallic nanocontacts. Appl. Phys. Rev. 2017, 4, 031302.
Halbritter, A.; Csonka, S.; Kolesnychenko, O. Y.; Mihály, G.; Shklyarevskii, O. I.; Shklyarevskii, O. I.; Van Kempen, H. Connective neck evolution and conductance steps in hot point contacts. Phys. Rev. B 2002, 65, 045413.
Wen, Y. H.; Zhang, Y.; Zheng, J. C.; Zhu, Z. Z.; Sun, S. G. Orientation-dependent structural transition and melting of Au nanowires. J. Phys. Chem. C 2009, 113, 20611–20617.
Volk, A.; Knez, D.; Thaler, P.; Hauser, A. W.; Grogger, W.; Hofer, F.; Ernst, W. E. Thermal instabilities and Rayleigh breakup of ultrathin silver nanowires grown in helium nanodroplets. Phys. Chem. Chem. Phys. 2015, 17, 24570–24575.
Schnedlitz, M.; Lasserus, M.; Knez, D.; Hauser, A. W.; Hofer, F.; Ernst, W. E. Thermally induced breakup of metallic nanowires: Experiment and theory. Phys. Chem. Chem. Phys. 2017, 19, 9402–9408.
Wen, Y. H.; Zhu, Z. Z.; Zhu, R. Z.; Shao, G. F. Size effects on the melting of nickel nanowires: A molecular dynamics study. Phys. E Low Dimens. Syst. Nanostruct. 2004, 25, 47–54.
Moskovkin, P.; Panshenskov, M.; Lucas, S.; Solov’yov, A. V. Simulation of nanowire fragmentation by means of kinetic Monte Carlo approach: 2D case. Phys. Status Solidi B 2014, 251, 1456–1462.
Wu, W. K.; Pavloudis, T.; Verkhovtsev, A. V.; Solov’yov, A. V.; Palmer, R. E. Molecular dynamics simulation of nanofilament breakage in neuromorphic nanoparticle networks. Nanotechnology 2022, 33, 275602.
Koo, S.; Park, J.; Koo, S.; Kim, K. Local heat dissipation of Ag nanowire networks examined with scanning thermal microscopy. J. Phys. Chem. C 2021, 125, 6306–6312.
Kim, C. L.; Lee, J. Y.; Shin, D. G.; Yeo, J. S.; Kim, D. E. Mechanism of heat-induced fusion of silver nanowires. Sci. Rep. 2020, 10, 9271.
Sharvin, Y. V. A possible method for studying Fermi surfaces. Sov. Phys. JETP 1965, 21, 655.
Wexler, G. The size effect and the non-local Boltzmann transport equation in orifice and disk geometry. Proc. Phys. Soc. 1966, 89, 927–941.
Torres, J. A.; Pascual, J. I.; Sáenz, J. J. Theory of conduction through narrow constrictions in a three-dimensional electron gas. Phys. Rev. B 1994, 49, 16581–16584.
López-Suárez, M.; Melis, C.; Colombo, L.; Tarantino, W. Modeling charge transport in gold nanogranular films. Phys. Rev. Mater. 2021, 5, 126001.
Erts, D.; Olin, H.; Ryen, L.; Olsson, E.; Thölén, A. Maxwell and Sharvin conductance in gold point contacts investigated using TEM-STM. Phys. Rev. B 2000, 61, 12725–12727.
Ruzicka, J. Y.; Abu Bakar, F.; Hoeck, C.; Adnan, R.; Mcnicoll, C.; Kemmitt, T.; Cowie, B. C.; Metha, G. F.; Andersson, G. G.; Golovko, V. B. Toward control of gold cluster aggregation on TiO2 via surface treatments. J. Phys. Chem. C 2015, 119, 24465–24474.
Verkhovtsev, A. V.; Erofeev, Y.; Solov’yov, A. V. Soft landing of metal clusters on graphite: A molecular dynamics study. Eur. Phys. J. D 2020, 74, 205.
Bardotti, L.; Jensen, P.; Hoareau, A.; Treilleux, M.; Cabaud, B.; Perez, A.; Aires, F. C. S. Diffusion and aggregation of large antimony and gold clusters deposited on graphite. Surf. Sci. 1996, 367, 276–292.
Solov’yov, I. A.; Yakubovich, A. V.; Nikolaev, P. V.; Volkovets, I.; Solov’yov, A. V. MesoBioNano Explorer—A universal program for multiscale computer simulations of complex molecular structure and dynamics. J. Comput. Chem. 2012, 33, 2412–2439.
Sushko, G. B.; Solov’yov, I. A.; Solov’yov, A. V. Modeling MesoBioNano systems with MBN Studio made easy. J. Mol. Graphics Modell. 2019, 88, 247–260.
Gupta, R. P. Lattice relaxation at a metal surface. Phys. Rev. B 1981, 23, 6265–6270.
Cleri, F.; Rosato, V. Tight-binding potentials for transition metals and alloys. Phys. Rev. B 1993, 48, 22–33.
Brenner, D. W. Empirical potential for hydrocarbons for use in simulating the chemical vapor deposition of diamond films. Phys. Rev. B 1990, 42, 9458–9471.
Wang, W.; Wang, M.; Ambrosi, E.; Bricalli, A.; Laudato, M.; Sun, Z.; Chen, X. D.; Ielmini, D. Surface diffusion-limited lifetime of silver and copper nanofilaments in resistive switching devices. Nat. Commun. 2019, 10, 81.
Dick, V. V.; Solov’yov, I. A.; Solov’yov, A. V. Fragmentation pathways of nanofractal structures on surfaces. Phys. Rev. B 2011, 84, 115408.
J Topping. Investigations on the theory of the Brownian movement. Phys. Bull. 1956, 7, 281.
Jensen, P.; Blase, X.; Ordejón, P. First principles study of gold adsorption and diffusion on graphite. Surf. Sci. 2004, 564, 173–178.
Maruyama, Y. Temperature dependence of Lévy-type stick-slip diffusion of a gold nanocluster on graphite. Phys. Rev. B 2004, 69, 245408.
El Koraychy, E. Y.; Roncaglia, C.; Nelli, D.; Cerbelaud, M.; Ferrando, R. Growth mechanisms from tetrahedral seeds to multiply twinned Au nanoparticles revealed by atomistic simulations. Nanoscale Horiz. 2022, 7, 883–889.
Nelli, D.; Rossi, G.; Wang, Z. W.; Palmer, R. E.; Ferrando, R. Structure and orientation effects in the coalescence of Au clusters. Nanoscale 2020, 12, 7688–7699.
Pavloudis, T.; Kioseoglou, J.; Palmer, R. E. Bonding of gold nanoclusters on graphene with and without point defects. Nanomaterials 2020, 10, 2109.
Arcidiacono, S.; Bieri, N. R.; Poulikakos, D.; Grigoropoulos, C. P. On the coalescence of gold nanoparticles. Int. J. Multiphase Flow 2004, 30, 979–994.
Giovannetti, G.; Khomyakov, P. A.; Brocks, G.; Karpan, V. M.; Van Den Brink, J.; Kelly, P. J. Doping graphene with metal contacts. Phys. Rev. Lett. 2008, 101, 026803.
759
Views
56
Downloads
1
Crossref
1
Web of Science
1
Scopus
0
CSCD
Altmetrics
Copyright: © 2023 by the author(s). This article is an open access article distributed under Creative Commons Attribution License (CC BY 4.0), visit https://creativecommons.org/licenses/by/4.0/.