Kurum Yazarı "Durandurdu, Murat" Araştırma Çıktıları | TR-Dizin | WoS | Scopus | PubMed İçin Listeleme
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Pressure-induced phase transformations in amorphous arsenic
Durandurdu, Murat (ELSEVIERRADARWEG 29, 1043 NX AMSTERDAM, NETHERLANDS, 2016)The atomic structure of amorphous arsenic and its response to high pressure are explored using a constant pressure ab initio molecular dynamics technique. Different analyzing techniques reveal that amorphous arsenic has a ... -
Theoretical investigation of substituent effects on the relative stabilities and electronic structure of [BnXn](2-) clusters
Tahaoglu, Duygu; Alkan, Fahri; Durandurdu, Murat (SPRINGERONE NEW YORK PLAZA, SUITE 4600 , NEW YORK, NY 10004, UNITED STATES, 2021)In this study, we provide a theoretical evaluation of relative stabilities and electronic structure for [BnXn](2-) clusters (n = 10, 12, 13, 14, 15, 16). Structural and electronic characteristics of [BnXn](2-) clusters are ... -
Uncovering Nanoclusters in Amorphous AlN: An Ab Initio Study
Durandurdu, Murat (WILEY, 2015)Amorphous AlN (a-AlN) is modeled by melt-and-quench technique using ab initio molecular dynamic simulations. For the first time, three-dimensional hexagonal-like nanoclusters embedded in amorphous matrix are proposed for ...