Atomistic Model of Wet Chemical Etching of Swift Heavy Ion Tracks

被引:4
作者
Gorbunov, S. A. [1 ]
Babaev, P. A. [1 ]
Rymzhanov, R. A. [2 ,3 ]
Volkov, A. E. [1 ,4 ]
Voronkov, R. A. [1 ]
机构
[1] Russian Acad Sci, PN Lebedev Phys Inst, Moscow 119991, Russia
[2] Joint Inst Nucl Res, Moscow 141980, Russia
[3] Inst Nucl Phys, Alma Ata 050032, Kazakhstan
[4] Kurchatov Inst, Natl Res Ctr, Moscow 123182, Russia
基金
俄罗斯科学基金会;
关键词
NUCLEAR TRACKS; MORPHOLOGY; KINETICS; ELECTRON; OLIVINE; DAMAGE; DISSOLUTION; MECHANISMS; SIMULATION; EXCITATION;
D O I
10.1021/acs.jpcc.2c07236
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
We present a multiscale model describing wet chemical etching of swift heavy ion tracks in olivine on the atomic scale. The approach combines the Monte Carlo code TREKIS and molecular dynamics for simulations of excitation and structure transformations of the material after an ion impact. Analysis of the obtained atomic positions in the proximity of the ion trajectory allows us to build up the algorithm of atomby-atom removal from the etching surface. The model describes the primary etching of the highly damaged cylindrical track core followed by dissociation of the peripheral region and formation of etched channels, cross-section shapes of which depend on the crystal orientations relative to the incident ion beam.
引用
收藏
页码:5090 / 5097
页数:8
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