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Pbam (55)
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Ab-initio phonon calculation for Ca3Tl2O6 / Pbam (55) / materials id 9216
Description/Abstract:
Ab-initio phonon calculation for Ca3Tl2O6 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Ca3Tl2O6
,
Pbam (55)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbCO2 / Pbam (55) / materials id 556872
Description/Abstract:
Ab-initio phonon calculation for RbCO2 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Pbam (55)
,
Phonon
, and
RbCO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sr4As3 / Pbam (55) / materials id 29424
Description/Abstract:
Ab-initio phonon calculation for Sr4As3 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Pbam (55)
,
Phonon
, and
Sr4As3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for K2HgH2Cl4O / Pbam (55) / materials id 23926
Description/Abstract:
Ab-initio phonon calculation for K2HgH2Cl4O / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
K2HgH2Cl4O
,
Pbam (55)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Rb3Sb5O14 / Pbam (55) / materials id 556234
Description/Abstract:
Ab-initio phonon calculation for Rb3Sb5O14 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Pbam (55)
,
Phonon
, and
Rb3Sb5O14
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Tl4PbI6 / Pbam (55) / materials id 29212
Description/Abstract:
Ab-initio phonon calculation for Tl4PbI6 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Pbam (55)
,
Phonon
, and
Tl4PbI6
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for KCO2 / Pbam (55) / materials id 560616
Description/Abstract:
Ab-initio phonon calculation for KCO2 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
KCO2
,
Pbam (55)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for RbTe / Pbam (55) / materials id 8360
Description/Abstract:
Ab-initio phonon calculation for RbTe / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Pbam (55)
,
Phonon
, and
RbTe
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Ca2HfO4 / Pbam (55) / materials id 752413
Description/Abstract:
Ab-initio phonon calculation for Ca2HfO4 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ca2HfO4
,
Pbam (55)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Pt(PbO2)2 / Pbam (55) / materials id 29332
Description/Abstract:
Ab-initio phonon calculation for Pt(PbO2)2 / Pbam (55) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Pbam (55)
,
Phonon
, and
Pt(PbO2)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
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MDR phonon calculation database
47
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Pbam (55)
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NIMS
47
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Visibility
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47
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
47
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47
Author
Atsushi Togo
47
Funder
MEXT
47
Software
VASP
47
phonopy
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spglib
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