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Samples (atom coordinates in .xyz format) for graphene/hexagonal-BN grain boundaries studied in the following paper: Haikuan Dong, Petri Hirvonen, Zheyong Fan, Ping Qian, Yanjing Su, and Tapio Ala-Nissila, Heat transport across graphene/hexagonal-BN heterostructures from phase-field crystal model and molecular dynamics simulations, submitted.
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