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CuCl
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Ab-initio phonon calculation for CuCl / F-43m (216) / materials id 22914
Description/Abstract:
Ab-initio phonon calculation for CuCl / F-43m (216) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CuCl
,
F-43m (216)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CuCl / Pa-3 (205) / materials id 23287
Description/Abstract:
Ab-initio phonon calculation for CuCl / Pa-3 (205) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CuCl
,
Pa-3 (205)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
XAFS spectrum of Copper(I) chloride, anhydrous
Description/Abstract:
This dataset consists of X-ray absorption fine structure (XAFS) spectra at Cu K-edge of Copper(I) chloride, anhydrous measured at SPring-...
Keyword:
BL14B2
,
Chloride
,
Copper(I) chloride, anhydrous
,
Cu K-edge
,
CuCl
,
SPring-8
,
Si(111)
,
XAFS
, and
collection - MDR XAFS DB
Material/Specimen:
Copper(I) chloride, anhydrous
Resource Type:
Dataset
Data origin:
experiments
Contact person:
Industrial Application and Partnership Division
Date Uploaded:
08/11/2021
XAFS spectrum of Copper(I) chloride, anhydrous
Description/Abstract:
This dataset consists of X-ray absorption fine structure (XAFS) spectra at Cu K-edge of Copper(I) chloride, anhydrous measured at SPring-...
Keyword:
BL14B2
,
Chloride
,
Copper(I) chloride, anhydrous
,
Cu K-edge
,
CuCl
,
SPring-8
,
Si(311)
,
XAFS
, and
collection - MDR XAFS DB
Material/Specimen:
Copper(I) chloride, anhydrous
Resource Type:
Dataset
Data origin:
experiments
Contact person:
Industrial Application and Partnership Division
Date Uploaded:
08/11/2021
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Type of work
Dataset
4
Collection
MDR XAFS DB
2
MDR phonon calculation database
1
Keyword
CuCl
[remove]
4
BL14B2
2
Chloride
2
Copper(I) chloride, anhydrous
2
Cu K-edge
2
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Publisher
NIMS
2
Resource type
Dataset
4
Visibility
open
4
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
2
Creative Commons BY-NC-SA Attribution-NonCommercial-ShareAlike 4.0 International
2
Data origin
experiments
2
simulation
2
Characterization methods
spectroscopy -- x-ray absorption spectroscopy
2
Material/Specimen
Copper(I) chloride, anhydrous
2
Author
Atsushi Togo
2
Contact person
Industrial Application and Partnership Division
2
Instrument manufacturer
Japan Synchrotron Radiation Research Institute
2
Instrument managing organization
Japan Synchrotron Radiation Research Institute
2
Funder
MEXT
2
Software
VASP
2
phonopy
2
spglib
2