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Published in 2018 at "Ferroelectrics"
DOI: 10.1080/00150193.2018.1474636
Abstract: Abstract In previous work, molecular dynamics simulations based on a first-principles-derived effective Hamiltonian for Pb1-X(Sc1/2Nb1/2)O3-X (PSN), with nearest-neighbor Pb-O divacancy pairs, was used to calculate X[Pb-O] vs. T, phase diagrams for PSN with: ideal rock-salt…
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Keywords:
relaxor transition;
psn nearest;
pnr relaxor;
nearest neighbor ... See more keywords