Development and validation of generalized Monte Carlo track-structure simulation model applicable to arbitrary ions in arbitrary materials

Ogawa, Tatsuhiko   ; Hirata, Yuho   ; Matsuya, Yusuke  ; Kai, Takeshi   

A track structure simulation model, ITSART Ver.2, has been developed to simulate the transport of arbitrary ions in arbitrary materials, accounting for every atomic interaction on an event-by-event basis. Unlike conventional track structure models, which are typically designed for therapeutic particle beams or bio-molecular targets, ITSART Ver.2 uniquely enables track structure calculations for any ion-material combination across an energy range from 10 eV/n to 1 TeV/n. To validate the developed model, the energy-angular distributions of secondary electrons, ion stopping ranges, radial dose distributions, and microscopic dose distributions calculated by ITSART Ver.2 were benchmarked against literature data. The unique features of ITSART Ver.2, including kinetic modeling of secondary electrons above 1 keV, modeling of secondary electron angular distribution, consideration of momentum transfer to target atoms, and interface with an atomic de-excitation model, resulted in calculations that were consistent with the benchmarking data. Furthermore, this benchmarking calculation demonstrated that ITSART Ver.2 can reproduce target-specific quantities such as Auger electron production and penumbra radial dose, which cannot be simulated with conventional codes that approximate the target as water. The capability of ITSART Ver.2 to perform track structure calculations under unconventional conditions paves the way for simulating various irradiation eff ects, such as reactor material irradiation damage, semiconductor device degradation, and other complex interactions.