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Hydrogenated amorphous boron nitride: A first principles study 

Üçhöyük, Tevhide Ayça; Durandurdu, Murat (Elsevier, 2018)
The influence of hydrogenation on the atomic structure and electronic properties of amorphous boron nitride (?-BN) is investigated by using an ab-initio molecular dynamics technique. The structural evaluation of ?-BN and ...
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An in-depth investigation of Mg-Zn-Ca metallic glasses: A first principles study 

Erkartal, Mustafa; Durandurdu, Murat (Elsevier, 2018)
The atomic structures, glass forming evolutions, mechanical properties and high pressure behavior of Mg75Zn20Ca5 and Mg60Zn35Ca5 bulk metallic glasses, which are promising candidates for biomedical implants, have been ...
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Amorphous silicon triboride: A first principles study 

Ozlem, Aysegul; Karacaoglan, Cetin; Durandurdu, Murat (ELSEVIER, RADARWEG 29, 1043 NX AMSTERDAM, NETHERLANDS, 15.05.2020)
Using ab initio molecular dynamics simulations, an amorphous silicon triboride (a-SiB3) network is generated and its atomic structure, electronic features and mechanical properties are compared with those of the crystal. ...
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High pressure modifications in amorphous boron suboxide: An ab initio study 

Durandurdu, Murat (ELSEVIER SCI LTD, THE BOULEVARD, LANGFORD LANE, KIDLINGTON, OXFORD OX5 1GB, OXON, ENGLAND, 01.04.2020)
Using constant pressure ab initio calculations, we probe the high-pressure modifications in amorphous boron suboxide (B6O) consisting of glassy boron trioxide (B2O3) and boron (B) domains up to a theoretical pressure of ...
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Amorphous boron carbide from ab initio simulations 

Yildiz, Tevhide Ayca; Durandurdu, Murat (ELSEVIER, RADARWEG 29, 1043 NX AMSTERDAM, NETHERLANDS, 15.02.2020)
An amorphous boron carbide (a-B4C) model is generated by means of ab-initio molecular dynamics calculations within a generalized gradient approximation and its structural, mechanical and electrical features are discussed ...
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Amorphous boron arsenide 

Durandurdu, Murat (ELSEVIER, RADARWEG 29, 1043 NX AMSTERDAM, NETHERLANDS, 15.11.2019)
The short-range order and electrical properties of amorphous boron arsenide (BAs) are evaluated by means of ab initio molecular dynamics simulations. The amorphous model is obtained from the fast solidification of the BAs ...
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Very low density amorphous phase of zircon 

Bolat, Suleyman; Durandurdu, Murat (ELSEVIER SCIENCE BV, PO BOX 211, 1000 AE AMSTERDAM, NETHERLANDS, 01.06.2019)
Using a reliable ab initio molecular dynamics method, we investigate the rapid solidification of the zircon melt. Accompanied by amorphization, a drastic volume expansion of 27% is perceived. This value is fairly larger ...



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Durandurdu, Murat (7)
Bolat, Suleyman (1)Erkartal, Mustafa (1)Karacaoglan, Cetin (1)Ozlem, Aysegul (1)Yildiz, Tevhide Ayca (1)Üçhöyük, Tevhide Ayça (1)Subject
Amorphous (7)
Hardness (2)Mechanical properties (2)Ab-initio (1)Boron arsenide (1)Boron carbide (1)Boron nitride (1)Boron suboxide (1)Densification (1)Electronic structure (1)... View MoreDate Issued2018 (2)Has File(s)Yes (7)

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