References
- Malerba L. Molecular dynamics simulation of displacement cascades in α-fe: a critical review. J Nucl Mater. 2006;351:28–38. Proceedings of the Symposium on Microstructural Processes in Irradiated Materials. Available from: http://www.sciencedirect.com/science/article/pii/S0022311506000638. doi: 10.1016/j.jnucmat.2006.02.023
- Stoller R. Primary radiation damage formation. In: Konings RJ, editor. Comprehensive nuclear materials. Oxford: Elsevier; 2012. p. 293–332. Available from: https://www.sciencedirect.com/science/article/pii/B9780080560335000276.
- Flynn CP, Averback RS. Electron-phonon interactions in energetic displacement cascades. Phys Rev B. 1988 Oct;38:7118–7120. Available from: https://link.aps.org/doi/10.1103/PhysRevB.38.7118.
- Stoneham A. Energy transfer between electrons and ions in collision cascades in solids. Nucl Instr Meth Phys Res Sect B Beam Interactions Mater Atoms. 1990;48:389–398. Available from: http://www.sciencedirect.com/science/article/pii/0168583X9090147M. doi: 10.1016/0168-583X(90)90147-M
- Caro A, Victoria M. Ion-electron interaction in molecular-dynamics cascades. Phys Rev A. 1989 Sep;40:2287–2291. Available from: https://link.aps.org/doi/10.1103/PhysRevA.40.2287.
- Duffy DM, Rutherford AM. Including the effects of electronic stopping and electron-ion interactions in radiation damage simulations. J Phys Condens Matter. 2007;19:016207. Available from: http://stacks.iop.org/0953-8984/19/i=1/a=016207. doi: 10.1088/0953-8984/19/1/016207
- Rutherford AM, Duffy DM. The effect of electron-ion interactions on radiation damage simulations. J Phys Condens Matter. 2007;19:496201. Available from: http://stacks.iop.org/0953-8984/19/i=49/a=496201. doi: 10.1088/0953-8984/19/49/496201
- Pinches MRS, Tildesley DJ, Smith W. Large scale molecular dynamics on parallel computers using the link-cell algorithm. Mol Simul. 1991;6:51–87. Available from: https://doi.org/10.1080/08927029108022139.
- Todorov IT, Smith W. DL_POLY_3: the CCP5 national UK code for molecular-dynamics simulations. Philos Trans R Soc London A. 2004;362:1835–1852. Available from: http://rsta.royalsocietypublishing.org/content/362/1822/1835.abstract. doi: 10.1098/rsta.2004.1419
- Todorov IT, Smith W, Trachenko K, et al. DL_POLY_3: new dimensions in molecular dynamics simulations via massive parallelism. J Mater Chem. 2006;16:1911–1918. doi: 10.1039/b517931a
- Plimpton S. Fast parallel algorithms for short-range molecular dynamics. J Comput Phys. 1995;117:1–19. Available from: http://www.sciencedirect.com/science/article/pii/S002199918571039X. doi: 10.1006/jcph.1995.1039
- Crank J. The mathematics of diffusion. 2nd ed. Oxford: Clarendon Press; 1975.
- Darkins R, Duffy DM. Modelling radiation effects in solids with two-temperature molecular dynamics. Comput Mater Sci. 2018;147:145–153. Available from: https://www.sciencedirect.com/science/article/pii/S0927025618300892. doi: 10.1016/j.commatsci.2018.02.006
- Seaton M, Anderson R, Metz S, et al. DL_MESO: highly scalable mesoscale simulations. Mol Simul. 2013;39:796–821. doi: 10.1080/08927022.2013.772297
- Norman GE, Starikov SV, Stegailov VV. Atomistic simulation of laser ablation of gold: effect of pressure relaxation. J Exp Theor Phys. 2012 May;114:792–800. Available from: https://doi.org/10.1134/S1063776112040115.
- Murphy ST, Daraszewicz SL, Giret Y, et al. Dynamical simulations of an electronically induced solid-solid phase transformation in tungsten. Phys Rev B. 2015 Oct;92:134110. Available from: https://link.aps.org/doi/10.1103/PhysRevB.92.134110.
- Zarkadoula E, Daraszewicz SL, Duffy DM, et al. Electronic effects in high-energy radiation damage in iron. J Phys Condens Matter. 2014;26:085401. Available from: http://stacks.iop.org/0953-8984/26/i=8/a=085401. doi: 10.1088/0953-8984/26/8/085401
- Malerba L, Marinica M, Anento N, et al. Comparison of empirical interatomic potentials for iron applied to radiation damage studies. J Nucl Mater. 2010;406:19–38. FP6 IP PERFECT Project: Prediction. doi: 10.1016/j.jnucmat.2010.05.017
- Daraszewicz S. The modelling of electronic effects in molecular dynamics simulations [EngD thesis]. Department of Physics and Astronomy & London Centre for Nanotechnology, University College London; 2013.
- Zarkadoula E, Devanathan R, Weber WJ, et al. High-energy radiation damage in zirconia: modeling results. J Appl Phys. 2014 Feb;115:083507. Available from: http://scitation.aip.org/content/aip/journal/jap/115/8/10.1063/1.4866989. doi: 10.1063/1.4866989
- Zarkadoula E, Duffy DM, Nordlund K, et al. Electronic effects in high-energy radiation damage in tungsten. J Phys Condens Matter. 2015;27:135401. Available from: http://stacks.iop.org/0953-8984/27/i=13/a=135401. doi: 10.1088/0953-8984/27/13/135401
- Zarkadoula E, Daraszewicz SL, Duffy DM, et al. The nature of high-energy radiation damage in iron. J Phys Condens Matter. 2013;252:125402. Available from: http://stacks.iop.org/0953-8984/25/i=12/a=125402.
- Zarkadoula E, Samolyuk G, Xue H, et al. Effects of two-temperature model on cascade evolution in Ni and NiFe. Scr Mater. 2016;124:6–10. Available from: http://www.sciencedirect.com/science/article/pii/S1359646216302822. doi: 10.1016/j.scriptamat.2016.06.028
- Zarkadoula E, Samolyuk G, Weber WJ. Effects of electronic excitation in 150 keV Ni ion irradiation of metallic systems. AIP Adv. 2018;8:015121. Available from: https://doi.org/10.1063/1.5016536.
- Zarkadoula E, Samolyuk G, Weber WJ. Two-temperature model in molecular dynamics simulations of cascades in Ni-based alloys. J Alloys Compd. 2017;700:106–112. Available from: http://www.sciencedirect.com/science/article/pii/S0925838816343705. doi: 10.1016/j.jallcom.2016.12.441
- Zarkadoula E, Samolyuk G, Weber WJ. Effects of the electron-phonon coupling activation in collision cascades. J Nucl Mater. 2017;490:317–322. Available from: http://www.sciencedirect.com/science/article/pii/S0022311517301216. doi: 10.1016/j.jnucmat.2017.04.020
- Zarkadoula E, Samolyuk G, Weber WJ. Effects of electronic excitation on cascade dynamics in nickel-iron and nickel-palladium systems. Scr Mater. 2017;138:124–129. Available from: http://www.sciencedirect.com/science/article/pii/S1359646217302932. doi: 10.1016/j.scriptamat.2017.05.041
- Giret Y, Naruse N, Daraszewicz SL, et al. Determination of transient atomic structure of laser-excited materials from time-resolved diffraction data. Appl Phys Lett. 2013;103:253107. Available from: http://scitation.aip.org/content/aip/journal/apl/103/25/10.1063/1.4847695. doi: 10.1063/1.4847695
- Daraszewicz SL, Giret Y, Naruse N, et al. Structural dynamics of laser-irradiated gold nanofilms. Phys Rev B. 2013 Nov;88:184101. Available from: http://link.aps.org/doi/10.1103/PhysRevB.88.184101.
- Murphy ST, Giret Y, Daraszewicz SL, et al. Contribution of electronic excitation to the structural evolution of ultrafast laser-irradiated tungsten nanofilms. Phys Rev B. 2016 Mar;93:104105. Available from: https://link.aps.org/doi/10.1103/PhysRevB.93.104105.
- Daraszewicz S, Duffy D. Hybrid continuum-atomistic modelling of swift heavy ion radiation damage in germanium. Nucl Instrum Methods Phys Res Section B Beam Interactions Mater Atoms. 2013;303:112–115. Proceedings of the 11th Computer Simulation of Radiation Effects in Solids (COSIRES) Conference Santa Fe, New Mexico, USA, July 24-29, 2012. Available from: http://www.sciencedirect.com/science/article/pii/S0168583X12007690. doi: 10.1016/j.nimb.2012.11.027
- van Driel HM. Kinetics of high-density plasmas generated in Si by 1.06- and 0.53-μm picosecond laser pulses. Phys Rev B. 1987 May;35:8166–8176. Available from: https://link.aps.org/doi/10.1103/PhysRevB.35.8166.
- Khara GS, Murphy ST, Daraszewicz SL, et al. The influence of the electronic specific heat on swift heavy ion irradiation simulations of silicon. J Phys Condens Matter. 2016;28:395201. Available from: http://stacks.iop.org/0953-8984/28/i=39/a=395201. doi: 10.1088/0953-8984/28/39/395201
- Khara GS, Murphy ST, Duffy DM. Dislocation loop formation by swift heavy ion irradiation of metals. J Phys Condens Matter. 2017;29:285303. Available from: http://stacks.iop.org/0953-8984/29/i=28/a=285303. doi: 10.1088/1361-648X/aa74f8