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Ab-initio phonon calculation for Ga3PO7 / R3m (160) / materials id 3107
Description/Abstract:
Ab-initio phonon calculation for Ga3PO7 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Ga3PO7
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for La2Th5O13 / R3m (160) / materials id 756142
Description/Abstract:
Ab-initio phonon calculation for La2Th5O13 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
La2Th5O13
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for NdH3(CO2)3 / R3m (160) / materials id 23837
Description/Abstract:
Ab-initio phonon calculation for NdH3(CO2)3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
NdH3(CO2)3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaCNO / R3m (160) / materials id 546500
Description/Abstract:
Ab-initio phonon calculation for NaCNO / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
NaCNO
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for TlIO3 / R3m (160) / materials id 22981
Description/Abstract:
Ab-initio phonon calculation for TlIO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
R3m (160)
, and
TlIO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ba3GeO5 / R3m (160) / materials id 770959
Description/Abstract:
Ab-initio phonon calculation for Ba3GeO5 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ba3GeO5
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 555763
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KHS / R3m (160) / materials id 38011
Description/Abstract:
Ab-initio phonon calculation for KHS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
KHS
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbIO3 / R3m (160) / materials id 27193
Description/Abstract:
Ab-initio phonon calculation for RbIO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
R3m (160)
, and
RbIO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Mg(GaO2)2 / R3m (160) / materials id 753846
Description/Abstract:
Ab-initio phonon calculation for Mg(GaO2)2 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Mg(GaO2)2
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LaWN3 / R3m (160) / materials id 989601
Description/Abstract:
Ab-initio phonon calculation for LaWN3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
LaWN3
,
Phonon
, and
R3m (160)
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 ZnS / R3m (160) / materials id 581476
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ca3SiO5 / R3m (160) / materials id 558273
Description/Abstract:
Ab-initio phonon calculation for Ca3SiO5 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ca3SiO5
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 581601
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for KBaLiZnF6 / R3m (160) / materials id 703273
Description/Abstract:
Ab-initio phonon calculation for KBaLiZnF6 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
KBaLiZnF6
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NaHO / R3m (160) / materials id 625051
Description/Abstract:
Ab-initio phonon calculation for NaHO / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
NaHO
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for WS2 / R3m (160) / materials id 9813
Description/Abstract:
Ab-initio phonon calculation for WS2 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
WS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NaAl11O17 / R3m (160) / materials id 759230
Description/Abstract:
Ab-initio phonon calculation for NaAl11O17 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
NaAl11O17
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for KClO3 / R3m (160) / materials id 550506
Description/Abstract:
Ab-initio phonon calculation for KClO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
KClO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CsGeCl3 / R3m (160) / materials id 22988
Description/Abstract:
Ab-initio phonon calculation for CsGeCl3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsGeCl3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for AgNO3 / R3m (160) / materials id 8196
Description/Abstract:
Ab-initio phonon calculation for AgNO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
AgNO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 555410
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for MoS2 / R3m (160) / materials id 1434
Description/Abstract:
Ab-initio phonon calculation for MoS2 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
MoS2
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for KAl11O17 / R3m (160) / materials id 760755
Description/Abstract:
Ab-initio phonon calculation for KAl11O17 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
KAl11O17
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for MgAl10O16 / R3m (160) / materials id 757911
Description/Abstract:
Ab-initio phonon calculation for MgAl10O16 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
MgAl10O16
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for BaCO3 / R3m (160) / materials id 4559
Description/Abstract:
Ab-initio phonon calculation for BaCO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
BaCO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 18377
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for InSe / R3m (160) / materials id 22691
Description/Abstract:
Ab-initio phonon calculation for InSe / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
InSe
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for K3B6BrO10 / R3m (160) / materials id 23612
Description/Abstract:
Ab-initio phonon calculation for K3B6BrO10 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
K3B6BrO10
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for CsClO3 / R3m (160) / materials id 760386
Description/Abstract:
Ab-initio phonon calculation for CsClO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CsClO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for KIO3 / R3m (160) / materials id 552729
Description/Abstract:
Ab-initio phonon calculation for KIO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
KIO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for H3BrO / R3m (160) / materials id 625509
Description/Abstract:
Ab-initio phonon calculation for H3BrO / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
H3BrO
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for GaSe / R3m (160) / materials id 11342
Description/Abstract:
Ab-initio phonon calculation for GaSe / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
GaSe
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 556468
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 554405
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 543011
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for CdI2 / R3m (160) / materials id 627401
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
CdI2
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for MgAl2O4 / R3m (160) / materials id 33302
Description/Abstract:
Ab-initio phonon calculation for MgAl2O4 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
MgAl2O4
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Zn3GaB6PO12 / R3m (160) / materials id 39215
Description/Abstract:
Ab-initio phonon calculation for Zn3GaB6PO12 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Phonon
,
R3m (160)
, and
Zn3GaB6PO12
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for CsGeI3 / R3m (160) / materials id 28377
Description/Abstract:
Ab-initio phonon calculation for CsGeI3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CsGeI3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for MoSe2 / R3m (160) / materials id 7581
Description/Abstract:
Ab-initio phonon calculation for MoSe2 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
MoSe2
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for H3ClO / R3m (160) / materials id 34078
Description/Abstract:
Ab-initio phonon calculation for H3ClO / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
H3ClO
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for GeTe / R3m (160) / materials id 938
Description/Abstract:
Ab-initio phonon calculation for GeTe / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
GeTe
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Tl3SbS3 / R3m (160) / materials id 8393
Description/Abstract:
Ab-initio phonon calculation for Tl3SbS3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R3m (160)
, and
Tl3SbS3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for SiC / R3m (160) / materials id 570641
Description/Abstract:
Ab-initio phonon calculation for SiC / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
SiC
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for RbClO3 / R3m (160) / materials id 23011
Description/Abstract:
Ab-initio phonon calculation for RbClO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R3m (160)
, and
RbClO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for CdI2 / R3m (160) / materials id 574663
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
CdI2
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for ZnS / R3m (160) / materials id 555858
Description/Abstract:
Ab-initio phonon calculation for ZnS / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Phonon
,
R3m (160)
, and
ZnS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for BaTiO3 / R3m (160) / materials id 5020
Description/Abstract:
Ab-initio phonon calculation for BaTiO3 / R3m (160) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
BaTiO3
,
Phonon
, and
R3m (160)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
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