The ion transport processes in homo- and heterovalent solid solutions based on the β-PbF2 crystal were studied using the molecular dynamics method. It was shown that the doping of this crystal with strontium fluoride leads to an increase in the mobility of fluorine atoms. The migration of fluorine by the vacancy mechanism explains the increase in the mobility of fluorine atoms in the Pb0.75Sr0.2K0.05F1.95 solid solution crystal.
Translated title of the contributionКОМПЬЮТЕРНОЕ МОДЕЛИРОВАНИЕ ФТОРИОННОЙ ПОДВИЖНОСТИ В КРИСТАЛЛЕ β-PbF2, ДОПИРОВАННОМ ФТОРИДАМИ СТРОНЦИЯ И КАЛИЯ
Original languageEnglish
Pages (from-to)2877-2879
JournalRussian Journal of General Chemistry
Volume92
Issue number12
DOIs
StatePublished - Dec 2022

    Research areas

  • ionic mobility, Inorganic fluorides, solid electrolytes, molecular dynamics, solid solution, lead fluoride

ID: 100825597