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UID:DSC-21373
DTSTART;TZID=Europe/Berlin:20241017T134000
SEQUENCE:1729143548
TRANSP:OPAQUE
DTEND;TZID=Europe/Berlin:20241017T154000
URL:https://dresden-science-calendar.org/calendar/de/detail/21373
LOCATION:TUD Materials Science - HAL\, Hallwachsstraße 301069 Dresden
SUMMARY:Curtarolo: From BIG data to HOT extreme-properties of high entropy 
 carbides carbo nitrides and borides
CLASS:PUBLIC
DESCRIPTION:Speaker: Stefano Curtarolo\nInstitute of Speaker: Materials Sci
 ence\, Electrical Engineering and Physics Director\, Center for Extreme Ma
 terials Duke University\nTopics:\nPhysik\n Location:\n  Name: TUD Material
 s Science - HAL (HAL Bürogebäude - 115)\n  Street: Hallwachsstraße 3\n 
  City: 01069 Dresden\n  Phone: \n  Fax: \nDescription: The need for improv
 ed functionalities in extreme environments is fueling interest in high ent
 ropy ceramics While resilient compositions can be stabilized by maximizing
  entropy still the search for new systems is mostly performed with trial a
 nd error and phenomenological techniques\, as effective computational disc
 overy is challenged by the immense number of configurations the synthesiza
 bility of high entropy ceramics is typically assessed using ideal entropy 
 along with the formation enthalpies from density functional theory\, with 
 simplified descriptors or machine learning methods. With re spect to vibra
 tions even if they may have significant impact on phase stability their co
 ntributions are drastically approximated to reduce the high computational 
 cost\, or often avoided with the hope of them being negligible\, due to th
 e technical difficulties posed in calculating disordered systems. In this 
 presentation I will address many of the problems solutions in the discover
 y of disordered ceramics [Nature\, 625\, 66 (2024)]  offer some data based
  effective solutions [Nat. Comms15\, 3328 (2024)] \, and discuss the avenu
 es opened by the latter\, especially for plasmonic hyperbolic applications
  ripe for ultra high temperature photocatalysis discoveries [Nat.Comms13\,
  5993 (2022)].
DTSTAMP:20260420T095948Z
CREATED:20241013T053632Z
LAST-MODIFIED:20241017T053908Z
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