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BEGIN:VEVENT
DTSTAMP:20260611T224820Z
DTSTART;VALUE=DATE-TIME:20250113T130000
DTEND;VALUE=DATE-TIME:20250113T140000
SUMMARY:WCPM: Naomi Hirayama\, Warwick
TZID:Europe/London
UID:20250113-8ac672c693cda1990193cfe3dbdb0c4e@warwick.ac.uk
CREATED:20250102T123647Z
DESCRIPTION:Location: A2.05B (there will be an informal sandwich lunch ou
 tside D2.02 at 12.30) Time: 13.00-14.00 To join this meeting online clic
 k here. Title: Theoretical Study on Local Structures in Fe-based Amorpho
 us Alloys Abstract: Local atomic arrangements\, such as short-range orde
 r and medium-range order\, are crucial in determining the physical prope
 rties of amorphous materials. Direct experimental observation of these m
 icroscopic structures is challenging\; nevertheless\, computational appr
 oaches such as molecular dynamics simulations afford valuable insights. 
 This study investigates Fe–Si–B amorphous alloys\, recognised for their 
 excellent soft magnetic properties\, making them promising candidates fo
 r high-efficiency motor core materials. However\, their challenging manu
 facturability has limited their widespread adoption. Addressing this iss
 ue requires a deeper understanding of the origins of their mechanical pr
 operties. In our study\, melt-quench simulations were conducted using a 
 machine learning potential based on the Gaussian approximation potential
  (GAP). The radial distribution functions obtained from these simulation
 s closely matched the experimental data. The results revealed that B-cen
 tred clusters predominantly exhibit anti-prism and trigonal prism struct
 ures\, while the Si-centred clusters are characterised by icosahedral an
 d related geometries. These cluster structures formed rapidly near the g
 lass transition temperature during quenching and subsequently coalesced 
 into networks. The modes of connection between cluster pairs—vertex\, ed
 ge\, face\, and multipoint sharing—were found to depend on the cluster t
 ype. The hierarchical ordering observed in these alloys should play a cr
 ucial role in understanding their mechanical behaviour. This study highl
 ights the potential of GAP for uncovering the structural properties of a
 morphous alloys\, offering a pathway to improve their manufacturability 
 and broader applicability. Bio: Background · 2020–Present: Associate Pro
 fessor (Next Generation Tatara Co-Creation Centre\, Shimane University) 
 · 2009–2020: Project Researcher (University of Tokyo\, Osaka University\
 , and others)\; Assistant Professor (Tokyo University of Science\, Tokyo
  Metropolitan University) · March 2009: PhD in Science (Ochanomizu Unive
 rsity\, Tokyo\, Japan) Research Field · Amorphous alloys: Investigation 
 of structural and mechanical properties using machine-learning molecular
  dynamics simulations · Thermoelectric materials: Calculation of electro
 nic and thermoelectric properties based on first-principles calculations
 .
LOCATION:A2.05B
CATEGORIES:WCPM,Women in Science
LAST-MODIFIED:20250102T123647Z
ORGANIZER;CN=Sarah Jarratt:
END:VEVENT
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