CuTlS

Type: Volume Composition

ObjectId: 3890 ExternalId: 2736

Created: 2/1/2023 3:33:13 PM by Vic) Dudarev Victor [vic_dudarev@mail.ru]

Access: Public Sort Code (asc): 0

Description: CuTlS

[no file attached]

: Cu-S-Tl

Composition

ElementAbsolutePercentage
Cu 1 33.333 %
Tl 1 33.333 %
S 1 33.333 %

Associated Objects

All properties (except table)

Include all template properties

No properties found

The table

CrystalSystem StructureType SpaceGroup Eg IsCalculated ReferenceId Comment
Tetragonal PbFCl P4/nmm 0.326 1 717 Indirect; DFT calculations, FLEUR code; with spin-orbit interaction
Tetragonal PbFCl P4/nmm 0.417 1 717 Indirect; DFT calculations, FLEUR code; without spin-orbit interaction
Tetragonal PbFCl P4/nmm 0.75 1 717 Direct; DFT calculations, FLEUR code; with spin-orbit interaction
Tetragonal PbFCl P4/nmm 0.917 1 717 Direct; DFT calculations, FLEUR code; without spin-orbit interaction