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Elucidating the enhanced photoelectrochemical performance of zinc-blende ZnS/wurtzite ZnO heterojunction and adsorption of water molecules by molecular dynamics simulations

Ronald VargasDepartamento de Química, Universidad Simón Bolívar (USB), Caracas, VenezuelaLorean MadrizInstituto de Investigaciones Fisicoquímicas Teóricas y Aplicadas (INIFTA), CCT-La Plata-CONICET, Universidad Nacional de La Plata (UNLP), Diag 113 y 64, La Plata, ArgentinaVictor MárquezDepartamento de Química, Universidad Simón Bolívar (USB), Caracas, VenezuelaDaniel TorresDepartamento de Química, Universidad Simón Bolívar (USB), Caracas, VenezuelaZukhra C. KadirovaDepartment of Inorganic Chemistry, Faculty of Chemistry, National University of Uzbekistan, University Street 4, 100174 Tashkent, UzbekistanKunio YubutaInstitute for Materials Research, Tohoku University, 2-1-1 Katahira, Aoba-ku, Sendai 980-8577, JapanMirabbos HojamberdievInstitut für Chemie, Technische Universität Berlin, Straße des 17. Juni 135, 10623 Berlin, Germany
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