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Ab-initio phonon calculation for PrClO / P4/nmm (129) / materials id 27984
Description/Abstract:
Ab-initio phonon calculation for PrClO / P4/nmm (129) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
P4/nmm (129)
,
Phonon
, and
PrClO
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for PrBrO / P4/nmm (129) / materials id 975666
Description/Abstract:
Ab-initio phonon calculation for PrBrO / P4/nmm (129) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
P4/nmm (129)
,
Phonon
, and
PrBrO
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Rb3YO3 / C2/m (12) / materials id 754146
Description/Abstract:
Ab-initio phonon calculation for Rb3YO3 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/m (12)
,
Phonon
, and
Rb3YO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for SmBi2IO4 / P4/mmm (123) / materials id 552292
Description/Abstract:
Ab-initio phonon calculation for SmBi2IO4 / P4/mmm (123) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
P4/mmm (123)
,
Phonon
, and
SmBi2IO4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Na3SrPCO7 / P2_1/m (11) / materials id 767431
Description/Abstract:
Ab-initio phonon calculation for Na3SrPCO7 / P2_1/m (11) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Na3SrPCO7
,
P2_1/m (11)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Ca2Nb2O7 / Pna2_1 (33) / materials id 560040
Description/Abstract:
Ab-initio phonon calculation for Ca2Nb2O7 / Pna2_1 (33) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ca2Nb2O7
,
Phonon
, and
Pna2_1 (33)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for TlPbCl3 / Fmm2 (42) / materials id 676598
Description/Abstract:
Ab-initio phonon calculation for TlPbCl3 / Fmm2 (42) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Fmm2 (42)
,
Phonon
, and
TlPbCl3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbAlPdF6 / Pnma (62) / materials id 18453
Description/Abstract:
Ab-initio phonon calculation for RbAlPdF6 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
RbAlPdF6
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for LiMgAs / F-43m (216) / materials id 12558
Description/Abstract:
Ab-initio phonon calculation for LiMgAs / F-43m (216) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
F-43m (216)
,
LiMgAs
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for PNCl2 / P4_2/n (86) / materials id 571213
Description/Abstract:
Ab-initio phonon calculation for PNCl2 / P4_2/n (86) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
P4_2/n (86)
,
PNCl2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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10,034
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MDR phonon calculation database
10,034
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10,034
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10,034
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10,034
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Atsushi Togo
10,034
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10,034
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10,034
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Science and Technology of Advanced Materials: Methods
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