Crystallography Open Database

Result : There are 6 entries in the selection

You can download the COD numbers of the selection as a text file

You can download all files as a single ZIP archive

Searching journal of publication like 'Computational Condensed Matter' volume of publication is 43

COD ID: 1574066
CIF file Formula: - Mn O3 Sr -
Comments: Lebeda, Miroslav; Drahokoupil, Jan; Kamba, Stanislav; Svoboda, Šimon; Smola, Vojtěch; Dabrowski, Bogdan; Vlčák, Petr Lattice parameters and bulk modulus of SrTi1-xMnxO3 perovskites: A comparison of exchange-correlation functionals with experimental validation Computational Condensed Matter 43 (2025) e01030
Space group: P m -3 m
Cell volume: 55.132
Cell parameters: 3.806; 3.806; 3.806; 90; 90; 90;  

COD ID: 1574067
CIF file Formula: - O3 Sr Ti -
Comments: Lebeda, Miroslav; Drahokoupil, Jan; Kamba, Stanislav; Svoboda, Šimon; Smola, Vojtěch; Dabrowski, Bogdan; Vlčák, Petr Lattice parameters and bulk modulus of SrTi1-xMnxO3 perovskites: A comparison of exchange-correlation functionals with experimental validation Computational Condensed Matter 43 (2025) e01030
Space group: P m -3 m
Cell volume: 59.589
Cell parameters: 3.9059; 3.9059; 3.9059; 90; 90; 90;  

COD ID: 1574068
CIF file Formula: - Mn0.1 O3 Sr Ti0.9 -
Comments: Lebeda, Miroslav; Drahokoupil, Jan; Kamba, Stanislav; Svoboda, Šimon; Smola, Vojtěch; Dabrowski, Bogdan; Vlčák, Petr Lattice parameters and bulk modulus of SrTi1-xMnxO3 perovskites: A comparison of exchange-correlation functionals with experimental validation Computational Condensed Matter 43 (2025) e01030
Space group: P m -3 m
Cell volume: 59.132
Cell parameters: 3.8959; 3.8959; 3.8959; 90; 90; 90;  

COD ID: 1574069
CIF file Formula: - Mn0.2 O3 Sr Ti0.8 -
Comments: Lebeda, Miroslav; Drahokoupil, Jan; Kamba, Stanislav; Svoboda, Šimon; Smola, Vojtěch; Dabrowski, Bogdan; Vlčák, Petr Lattice parameters and bulk modulus of SrTi1-xMnxO3 perovskites: A comparison of exchange-correlation functionals with experimental validation Computational Condensed Matter 43 (2025) e01030
Space group: P m -3 m
Cell volume: 58.746
Cell parameters: 3.8874; 3.8874; 3.8874; 90; 90; 90;  

COD ID: 1574070
CIF file Formula: - Mn0.3 O3 Sr Ti0.7 -
Comments: Lebeda, Miroslav; Drahokoupil, Jan; Kamba, Stanislav; Svoboda, Šimon; Smola, Vojtěch; Dabrowski, Bogdan; Vlčák, Petr Lattice parameters and bulk modulus of SrTi1-xMnxO3 perovskites: A comparison of exchange-correlation functionals with experimental validation Computational Condensed Matter 43 (2025) e01030
Space group: P m -3 m
Cell volume: 58.231
Cell parameters: 3.876; 3.876; 3.876; 90; 90; 90;  

COD ID: 1574071
CIF file Formula: - Mn0.5 O3 Sr Ti0.5 -
Comments: Lebeda, Miroslav; Drahokoupil, Jan; Kamba, Stanislav; Svoboda, Šimon; Smola, Vojtěch; Dabrowski, Bogdan; Vlčák, Petr Lattice parameters and bulk modulus of SrTi1-xMnxO3 perovskites: A comparison of exchange-correlation functionals with experimental validation Computational Condensed Matter 43 (2025) e01030
Space group: P m -3 m
Cell volume: 57.521
Cell parameters: 3.8602; 3.8602; 3.8602; 90; 90; 90;  


Back to the search form
Your own data is not in the COD? Deposit it, thanks!
Top of the page
All data in the COD and the database itself are dedicated to the public domain and licensed under the CC0 License . Users of the data should acknowledge the original authors of the structural data.