Ba3Zr2S7
Type: Volume Composition show more
ObjectId: 5155 ExternalId: 4083
Created: 2/1/2023 3:33:19 PM by Vic) Dudarev Victor [vic_dudarev@mail.ru]
Access: Public Sort Code (asc): 0
Description: Ba3Zr2S7
[no file attached]
: Ba-S-Zr
Composition
| Element | Absolute | Percentage | |
|---|---|---|---|
| Ba | 3 | 25 % | |
| Zr | 2 | 16.667 % | |
| S | 7 | 58.333 % |
Associated Objects
-
Niu S.,Sarkar D.,Williams K.,Zhou Y.,Li Y.,Bianco E.,Huyan H.,Cronin S
Literature ReferenceNiu S.,Sarkar D.,Williams K.,Zhou Y.,Li Y.,Bianco E.,Huyan H.,Cronin S.B.,McConney M.E.,Haiges R.,Jaramillo R.,Singh D.J.,Tisdale W.A.,Kapadia R.,Ravichandran J. Optimal Bandgap in a 2D Ruddlesden-Popper Perovskite Chalcogenide for Single-junction Solar Ce
All properties (except table)
No properties found
The table
| CrystalSystem | SpaceGroup | Eg | IsCalculated | ReferenceId | Comment |
|---|---|---|---|---|---|
| Tetragonal | I4/mmm | 0.957 | 1 | 1025 | Indirect. Calculation. WIEN2k package |
| Tetragonal | I4/mmm | 1.256 | 1 | 1025 | Direct. Calculation. WIEN2k package |
| Tetragonal | P42/mnm | 1.25 | 1 | 1025 | Indirect. Calculation. WIEN2k package |
| Tetragonal | P42/mnm | 1.35 | 1 | 1025 | Direct. Calculation. WIEN2k package |