Sc2CCl2
Type: Volume Composition show more
ObjectId: 5853 ExternalId: 4884
Created: 2/1/2023 3:33:23 PM by Vic) Dudarev Victor [vic_dudarev@mail.ru]
Access: Public Sort Code (asc): 0
Description: Sc2CCl2
[no file attached]
: C-Cl-Sc
Composition
| Element | Absolute | Percentage | |
|---|---|---|---|
| Sc | 2 | 40 % | |
| C | 1 | 20 % | |
| Cl | 2 | 40 % |
Associated Objects
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Mostafaei A.,Abbasnejad M. Computational studies on the structural, el
Literature ReferenceMostafaei A.,Abbasnejad M. Computational studies on the structural, electronic and optical properties of M2CT2 (M = Y, Sc and T = F, Cl) MXene monolayer
All properties (except table)
No properties found
The table
| CrystalSystem | SpaceGroup | Eg | IsCalculated | ReferenceId | Comment | Direction |
|---|---|---|---|---|---|---|
| Hexagonal | P3(-)m1 | 0.88 | 1 | 1441 | Indirect.Calculation. WIEN2k package. PBE | |
| Hexagonal | P3(-)m1 | 1.31 | 1 | 1441 | Indirect.Calculation. WIEN2k package. TB-mBJ | |
| Hexagonal | P3(-)m1 | 1.57 | 1 | 1441 | Indirect.Calculation. WIEN2k package. TB-mBJ | ||x |
| Hexagonal | P3(-)m1 | 1.83 | 1 | 1441 | Indirect.Calculation. WIEN2k package. TB-mBJ | ||z |