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Ab-initio phonon calculation for CuI / P6_3mc (186) / materials id 569346
Description/Abstract:
Ab-initio phonon calculation for CuI / P6_3mc (186) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CuI
,
P6_3mc (186)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for CuI / P-3m1 (164) / materials id 570081
Description/Abstract:
Ab-initio phonon calculation for CuI / P-3m1 (164) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CuI
,
P-3m1 (164)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CuI / R3m (160) / materials id 22895
Description/Abstract:
Ab-initio phonon calculation for CuI / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
CuI
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CuI / P3m1 (156) / materials id 570136
Description/Abstract:
Ab-initio phonon calculation for CuI / P3m1 (156) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
CuI
,
P3m1 (156)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for CuI / R3m (160) / materials id 32750
Description/Abstract:
Ab-initio phonon calculation for CuI / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
CuI
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for CuI / P1 (1) / materials id 673245
Description/Abstract:
Ab-initio phonon calculation for CuI / P1 (1) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw da...
Keyword:
CuI
,
P1 (1)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
XAFS spectrum of Copper(I) iodide, anhydrous
Description/Abstract:
This dataset consists of X-ray absorption fine structure (XAFS) spectra at I K-edge of Copper(I) iodide, anhydrous measured at Photon Fac...
Keyword:
AR-NW10A
,
Copper(I) iodide, anhydrous
,
CuI
,
I K-edge
,
Iodide
,
Photon Factory
,
Si(311)
,
XAFS
, and
collection - MDR XAFS DB
Resource Type:
Dataset
Data origin:
experiments
Date Uploaded:
08/07/2022
XAFS spectrum of Copper(I) iodide, anhydrous
Description/Abstract:
This dataset consists of X-ray absorption fine structure (XAFS) spectra at I L3-edge of Copper(I) iodide, anhydrous measured at Photon Fa...
Keyword:
BL-9A
,
Copper(I) iodide, anhydrous
,
CuI
,
I L3-edge
,
Iodide
,
Photon Factory
,
Si(111)
,
XAFS
, and
collection - MDR XAFS DB
Resource Type:
Dataset
Data origin:
experiments
Date Uploaded:
08/07/2022
XAFS spectrum of Copper(I) iodide, anhydrous
Description/Abstract:
This dataset consists of X-ray absorption fine structure (XAFS) spectra at Cu K-edge of Copper(I) iodide, anhydrous measured at SPring-8 ...
Keyword:
BL14B2
,
Copper(I) iodide, anhydrous
,
Cu K-edge
,
CuI
,
Iodide
,
SPring-8
,
Si(111)
,
XAFS
, and
collection - MDR XAFS DB
Material/Specimen:
Copper(I) iodide, anhydrous
Resource Type:
Dataset
Data origin:
experiments
Contact person:
Industrial Application and Partnership Division
Date Uploaded:
24/07/2021
XAFS spectrum of Copper(I) iodide, anhydrous
Description/Abstract:
This dataset consists of X-ray absorption fine structure (XAFS) spectra at Cu K-edge of Copper(I) iodide, anhydrous measured at SPring-8 ...
Keyword:
BL14B2
,
Copper(I) iodide, anhydrous
,
Cu K-edge
,
CuI
,
Iodide
,
SPring-8
,
Si(311)
,
XAFS
, and
collection - MDR XAFS DB
Material/Specimen:
Copper(I) iodide, anhydrous
Resource Type:
Dataset
Data origin:
experiments
Contact person:
Industrial Application and Partnership Division
Date Uploaded:
24/07/2021
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Type of work
Dataset
10
Collection
MDR phonon calculation database
6
MDR XAFS DB
4
Keyword
CuI
[remove]
10
Phonon
6
Copper(I) iodide, anhydrous
4
Iodide
4
XAFS
4
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Keywords
»
Publisher
NIMS
6
Resource type
Dataset
10
Visibility
open
10
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
6
Creative Commons BY-NC-SA Attribution-NonCommercial-ShareAlike 4.0 International
4
Data origin
simulation
6
experiments
4
Characterization methods
spectroscopy -- x-ray absorption spectroscopy
4
Material/Specimen
Copper(I) iodide, anhydrous
2
Author
Atsushi Togo
6
Contact person
Industrial Application and Partnership Division
2
Instrument manufacturer
Japan Synchrotron Radiation Research Institute
2
Photon Factory
2
Instrument managing organization
Japan Synchrotron Radiation Research Institute
2
Structural feature category
https://matvoc.nims.go.jp/entity/Q686
2
Funder
MEXT
6
Software
VASP
6
phonopy
6
spglib
6