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Filtering by: Data origin simulation Type of work Dataset Keyword P2_1/c (14) Collection MDR phonon calculation database

1. Ab-initio phonon calculation for KPr3Te8 / P2_1/c (14) / materials id 567710

Description/Abstract:: Ab-initio phonon calculation for KPr3Te8 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:: KPr3Te8, P2_1/c (14), and Phonon
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

2. Ab-initio phonon calculation for LaMg(BO2)5 / P2_1/c (14) / materials id 557758

Description/Abstract:: Ab-initio phonon calculation for LaMg(BO2)5 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:: LaMg(BO2)5, P2_1/c (14), and Phonon
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

3. Ab-initio phonon calculation for LiPr(SO4)2 / P2_1/c (14) / materials id 559719

Description/Abstract:: Ab-initio phonon calculation for LiPr(SO4)2 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:: LiPr(SO4)2, P2_1/c (14), and Phonon
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

4. Ab-initio phonon calculation for TbZn(BO2)5 / P2_1/c (14) / materials id 15520

Description/Abstract:: Ab-initio phonon calculation for TbZn(BO2)5 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:: P2_1/c (14), Phonon, and TbZn(BO2)5
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

5. Ab-initio phonon calculation for TiAs2O7 / P2_1/c (14) / materials id 17196

Description/Abstract:: Ab-initio phonon calculation for TiAs2O7 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:: P2_1/c (14), Phonon, and TiAs2O7
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

6. Ab-initio phonon calculation for Bi9AuBr9 / P2_1/c (14) / materials id 684015

Description/Abstract:: Ab-initio phonon calculation for Bi9AuBr9 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:: Bi9AuBr9, P2_1/c (14), and Phonon
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

7. Ab-initio phonon calculation for PrPtF7 / P2_1/c (14) / materials id 17446

Description/Abstract:: Ab-initio phonon calculation for PrPtF7 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:: P2_1/c (14), Phonon, and PrPtF7
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

8. Ab-initio phonon calculation for Na2Si2O5 / P2_1/c (14) / materials id 556423

Description/Abstract:: Ab-initio phonon calculation for Na2Si2O5 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:: Na2Si2O5, P2_1/c (14), and Phonon
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

9. Ab-initio phonon calculation for Cd3(AsO4)2 / P2_1/c (14) / materials id 13602

Description/Abstract:: Ab-initio phonon calculation for Cd3(AsO4)2 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:: Cd3(AsO4)2, P2_1/c (14), and Phonon
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

10. Ab-initio phonon calculation for HoPtF7 / P2_1/c (14) / materials id 17651

Description/Abstract:: Ab-initio phonon calculation for HoPtF7 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:: HoPtF7, P2_1/c (14), and Phonon
Resource Type:: Dataset
Data origin:: simulation
Author:: Atsushi Togo
Date Uploaded:: 27/05/2023

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