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Ab-initio phonon calculation for BN / P6_3/mmc (194) / materials id 984
Description/Abstract:
Ab-initio phonon calculation for BN / P6_3/mmc (194) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
BN
,
P6_3/mmc (194)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for BN / P6_3/mmc (194) / materials id 629015
Description/Abstract:
Ab-initio phonon calculation for BN / P6_3/mmc (194) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
BN
,
P6_3/mmc (194)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for BN / P6_3/mmc (194) / materials id 7991
Description/Abstract:
Ab-initio phonon calculation for BN / P6_3/mmc (194) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
BN
,
P6_3/mmc (194)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
XAFS spectrum of Hexagonal boron nitride
Description/Abstract:
This dataset consists of X-ray absorption fine structure (XAFS) spectra at B K-edge of Hexagonal boron nitride measured at Ritsumeikan-SR...
Keyword:
B K-edge
,
BL-11
,
BN
,
Hexagonal boron nitride
,
Nitride
,
Ritsumeikan-SR
,
XAFS
, and
collection - MDR XAFS DB
Resource Type:
Dataset
Data origin:
experiments
Date Uploaded:
08/06/2022
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MDR phonon calculation database
3
MDR XAFS DB
1
Keyword
BN
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4
P6_3/mmc (194)
3
Phonon
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B K-edge
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NIMS
3
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Creative Commons BY Attribution 4.0 International
3
Creative Commons BY-NC-SA Attribution-NonCommercial-ShareAlike 4.0 International
1
Data origin
simulation
3
experiments
1
Characterization methods
spectroscopy -- x-ray absorption spectroscopy
1
Author
Atsushi Togo
3
Instrument manufacturer
Ritsumeikan SR Center
1
Instrument managing organization
Ritsumeikan University
1
Instrument managing sub organization
Ritsumeikan SR Center
1
Structural feature category
https://matvoc.nims.go.jp/entity/Q686
1
Funder
MEXT
3
Software
VASP
3
phonopy
3
spglib
3