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Ab-initio phonon calculation for NdZnPO / R-3m (166) / materials id 9518
Description/Abstract:
Ab-initio phonon calculation for NdZnPO / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
NdZnPO
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for KErTe2 / R-3m (166) / materials id 9263
Description/Abstract:
Ab-initio phonon calculation for KErTe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
KErTe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for KPrS2 / R-3m (166) / materials id 15782
Description/Abstract:
Ab-initio phonon calculation for KPrS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KPrS2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Bi2Se3 / R-3m (166) / materials id 541837
Description/Abstract:
Ab-initio phonon calculation for Bi2Se3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Bi2Se3
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for KTmO2 / R-3m (166) / materials id 753774
Description/Abstract:
Ab-initio phonon calculation for KTmO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KTmO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KPt2Se3 / R-3m (166) / materials id 14796
Description/Abstract:
Ab-initio phonon calculation for KPt2Se3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
KPt2Se3
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KScO2 / R-3m (166) / materials id 8188
Description/Abstract:
Ab-initio phonon calculation for KScO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KScO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaN3 / R-3m (166) / materials id 22003
Description/Abstract:
Ab-initio phonon calculation for NaN3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
NaN3
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb3B12H12Cl / R-3m (166) / materials id 24798
Description/Abstract:
Ab-initio phonon calculation for Rb3B12H12Cl / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Phonon
,
R-3m (166)
, and
Rb3B12H12Cl
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaHoS2 / R-3m (166) / materials id 5694
Description/Abstract:
Ab-initio phonon calculation for NaHoS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
NaHoS2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiAlO2 / R-3m (166) / materials id 8001
Description/Abstract:
Ab-initio phonon calculation for LiAlO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
LiAlO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ReCl3 / R-3m (166) / materials id 23174
Description/Abstract:
Ab-initio phonon calculation for ReCl3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
ReCl3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbHoS2 / R-3m (166) / materials id 9366
Description/Abstract:
Ab-initio phonon calculation for RbHoS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
RbHoS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ScAgO2 / R-3m (166) / materials id 973185
Description/Abstract:
Ab-initio phonon calculation for ScAgO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
ScAgO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb2O / R-3m (166) / materials id 753746
Description/Abstract:
Ab-initio phonon calculation for Rb2O / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
R-3m (166)
, and
Rb2O
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CdI2 / R-3m (166) / materials id 573588
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for PbI2 / R-3m (166) / materials id 640058
Description/Abstract:
Ab-initio phonon calculation for PbI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
PbI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BaPbF6 / R-3m (166) / materials id 19799
Description/Abstract:
Ab-initio phonon calculation for BaPbF6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
BaPbF6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ca3(PO4)2 / R-3m (166) / materials id 3487
Description/Abstract:
Ab-initio phonon calculation for Ca3(PO4)2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ca3(PO4)2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Bi2TeSe2 / R-3m (166) / materials id 31406
Description/Abstract:
Ab-initio phonon calculation for Bi2TeSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Bi2TeSe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CaCN2 / R-3m (166) / materials id 4124
Description/Abstract:
Ab-initio phonon calculation for CaCN2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CaCN2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K4BeP2 / R-3m (166) / materials id 9872
Description/Abstract:
Ab-initio phonon calculation for K4BeP2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
K4BeP2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KErO2 / R-3m (166) / materials id 7959
Description/Abstract:
Ab-initio phonon calculation for KErO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KErO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Li6UO6 / R-3m (166) / materials id 8609
Description/Abstract:
Ab-initio phonon calculation for Li6UO6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Li6UO6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiRhO2 / R-3m (166) / materials id 14115
Description/Abstract:
Ab-initio phonon calculation for LiRhO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
LiRhO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for SrHgO2 / R-3m (166) / materials id 978857
Description/Abstract:
Ab-initio phonon calculation for SrHgO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
SrHgO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for TbRbSe2 / R-3m (166) / materials id 10782
Description/Abstract:
Ab-initio phonon calculation for TbRbSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
R-3m (166)
, and
TbRbSe2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsICl2 / R-3m (166) / materials id 22990
Description/Abstract:
Ab-initio phonon calculation for CsICl2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsICl2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Sr6La2Ta3Al5O24 / R-3m (166) / materials id 676456
Description/Abstract:
Ab-initio phonon calculation for Sr6La2Ta3Al5O24 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, a...
Keyword:
Phonon
,
R-3m (166)
, and
Sr6La2Ta3Al5O24
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K4ZnP2 / R-3m (166) / materials id 11719
Description/Abstract:
Ab-initio phonon calculation for K4ZnP2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
K4ZnP2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for PbI2 / R-3m (166) / materials id 540789
Description/Abstract:
Ab-initio phonon calculation for PbI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
PbI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CdCl2 / R-3m (166) / materials id 22881
Description/Abstract:
Ab-initio phonon calculation for CdCl2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CdCl2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K4BeAs2 / R-3m (166) / materials id 29584
Description/Abstract:
Ab-initio phonon calculation for K4BeAs2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
K4BeAs2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbTmS2 / R-3m (166) / materials id 9368
Description/Abstract:
Ab-initio phonon calculation for RbTmS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
RbTmS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for In4Br7 / R-3m (166) / materials id 568692
Description/Abstract:
Ab-initio phonon calculation for In4Br7 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
In4Br7
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Cs2NaGaF6 / R-3m (166) / materials id 6163
Description/Abstract:
Ab-initio phonon calculation for Cs2NaGaF6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Cs2NaGaF6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for TlBS2 / R-3m (166) / materials id 8946
Description/Abstract:
Ab-initio phonon calculation for TlBS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
TlBS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Lu2CCl2 / R-3m (166) / materials id 573376
Description/Abstract:
Ab-initio phonon calculation for Lu2CCl2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Lu2CCl2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaInSe2 / R-3m (166) / materials id 22473
Description/Abstract:
Ab-initio phonon calculation for NaInSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
NaInSe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for HfBrN / R-3m (166) / materials id 30302
Description/Abstract:
Ab-initio phonon calculation for HfBrN / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
HfBrN
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KYO2 / R-3m (166) / materials id 8409
Description/Abstract:
Ab-initio phonon calculation for KYO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
KYO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbNdTe2 / R-3m (166) / materials id 5808
Description/Abstract:
Ab-initio phonon calculation for RbNdTe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
R-3m (166)
, and
RbNdTe2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb2Sn2O3 / R-3m (166) / materials id 7863
Description/Abstract:
Ab-initio phonon calculation for Rb2Sn2O3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Phonon
,
R-3m (166)
, and
Rb2Sn2O3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Th3N4 / R-3m (166) / materials id 467
Description/Abstract:
Ab-initio phonon calculation for Th3N4 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
Th3N4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for SmAgO2 / R-3m (166) / materials id 753226
Description/Abstract:
Ab-initio phonon calculation for SmAgO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
SmAgO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for SmOF / R-3m (166) / materials id 9488
Description/Abstract:
Ab-initio phonon calculation for SmOF / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
R-3m (166)
, and
SmOF
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbLuSe2 / R-3m (166) / materials id 10785
Description/Abstract:
Ab-initio phonon calculation for RbLuSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
R-3m (166)
, and
RbLuSe2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for BiOF / R-3m (166) / materials id 752949
Description/Abstract:
Ab-initio phonon calculation for BiOF / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
BiOF
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for BaGeF6 / R-3m (166) / materials id 14006
Description/Abstract:
Ab-initio phonon calculation for BaGeF6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
BaGeF6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for YZnPO / R-3m (166) / materials id 12509
Description/Abstract:
Ab-initio phonon calculation for YZnPO / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
YZnPO
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Bi2PbSe4 / R-3m (166) / materials id 675543
Description/Abstract:
Ab-initio phonon calculation for Bi2PbSe4 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Bi2PbSe4
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sr4NdNb2Al3O15 / R-3m (166) / materials id 677283
Description/Abstract:
Ab-initio phonon calculation for Sr4NdNb2Al3O15 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, an...
Keyword:
Phonon
,
R-3m (166)
, and
Sr4NdNb2Al3O15
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for ZrBrN / R-3m (166) / materials id 541912
Description/Abstract:
Ab-initio phonon calculation for ZrBrN / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
ZrBrN
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Cs2LiInCl6 / R-3m (166) / materials id 571527
Description/Abstract:
Ab-initio phonon calculation for Cs2LiInCl6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Cs2LiInCl6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NaLuS2 / R-3m (166) / materials id 9035
Description/Abstract:
Ab-initio phonon calculation for NaLuS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
NaLuS2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for KLi6TaO6 / R-3m (166) / materials id 9059
Description/Abstract:
Ab-initio phonon calculation for KLi6TaO6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
KLi6TaO6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for DyTlSe2 / R-3m (166) / materials id 568062
Description/Abstract:
Ab-initio phonon calculation for DyTlSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
DyTlSe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CdBr2 / R-3m (166) / materials id 568722
Description/Abstract:
Ab-initio phonon calculation for CdBr2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CdBr2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for LaSb5O12 / R-3m (166) / materials id 31419
Description/Abstract:
Ab-initio phonon calculation for LaSb5O12 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
LaSb5O12
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbSmO2 / R-3m (166) / materials id 7974
Description/Abstract:
Ab-initio phonon calculation for RbSmO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
RbSmO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbErO2 / R-3m (166) / materials id 7477
Description/Abstract:
Ab-initio phonon calculation for RbErO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
RbErO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NdTlS2 / R-3m (166) / materials id 3664
Description/Abstract:
Ab-initio phonon calculation for NdTlS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
NdTlS2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for K4CdP2 / R-3m (166) / materials id 28302
Description/Abstract:
Ab-initio phonon calculation for K4CdP2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
K4CdP2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for ScCuO2 / R-3m (166) / materials id 4636
Description/Abstract:
Ab-initio phonon calculation for ScCuO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
ScCuO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NdTlSe2 / R-3m (166) / materials id 568588
Description/Abstract:
Ab-initio phonon calculation for NdTlSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
NdTlSe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sr3(PO4)2 / R-3m (166) / materials id 4632
Description/Abstract:
Ab-initio phonon calculation for Sr3(PO4)2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Phonon
,
R-3m (166)
, and
Sr3(PO4)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for HoBrO / R-3m (166) / materials id 755565
Description/Abstract:
Ab-initio phonon calculation for HoBrO / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
HoBrO
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for SiO2 / R-3m (166) / materials id 17909
Description/Abstract:
Ab-initio phonon calculation for SiO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
R-3m (166)
, and
SiO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbNdSe2 / R-3m (166) / materials id 10779
Description/Abstract:
Ab-initio phonon calculation for RbNdSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
R-3m (166)
, and
RbNdSe2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CdI2 / R-3m (166) / materials id 568233
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for LiCuF2 / R-3m (166) / materials id 753098
Description/Abstract:
Ab-initio phonon calculation for LiCuF2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
LiCuF2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbScO2 / R-3m (166) / materials id 8145
Description/Abstract:
Ab-initio phonon calculation for RbScO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
RbScO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbLuO2 / R-3m (166) / materials id 7480
Description/Abstract:
Ab-initio phonon calculation for RbLuO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
RbLuO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for TbCsS2 / R-3m (166) / materials id 9085
Description/Abstract:
Ab-initio phonon calculation for TbCsS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
TbCsS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for GaS / R-3m (166) / materials id 9889
Description/Abstract:
Ab-initio phonon calculation for GaS / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
GaS
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sr3Ta4(O6F)2 / R-3m (166) / materials id 756810
Description/Abstract:
Ab-initio phonon calculation for Sr3Ta4(O6F)2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
Phonon
,
R-3m (166)
, and
Sr3Ta4(O6F)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CsPrS2 / R-3m (166) / materials id 9080
Description/Abstract:
Ab-initio phonon calculation for CsPrS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsPrS2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CsHoS2 / R-3m (166) / materials id 505158
Description/Abstract:
Ab-initio phonon calculation for CsHoS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsHoS2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Na3Ir(NO2)6 / R-3m (166) / materials id 22102
Description/Abstract:
Ab-initio phonon calculation for Na3Ir(NO2)6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Na3Ir(NO2)6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for YCuO2 / R-3m (166) / materials id 6972
Description/Abstract:
Ab-initio phonon calculation for YCuO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
YCuO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for B6As / R-3m (166) / materials id 624
Description/Abstract:
Ab-initio phonon calculation for B6As / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
B6As
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Ga3NO3 / R-3m (166) / materials id 754781
Description/Abstract:
Ab-initio phonon calculation for Ga3NO3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ga3NO3
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for TmClO / R-3m (166) / materials id 772295
Description/Abstract:
Ab-initio phonon calculation for TmClO / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
TmClO
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for SmCuO2 / R-3m (166) / materials id 13695
Description/Abstract:
Ab-initio phonon calculation for SmCuO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
R-3m (166)
, and
SmCuO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for TlBiTe2 / R-3m (166) / materials id 27438
Description/Abstract:
Ab-initio phonon calculation for TlBiTe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
R-3m (166)
, and
TlBiTe2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for NaErS2 / R-3m (166) / materials id 3613
Description/Abstract:
Ab-initio phonon calculation for NaErS2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
NaErS2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for NaCrSe2 / R-3m (166) / materials id 3332
Description/Abstract:
Ab-initio phonon calculation for NaCrSe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
NaCrSe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for KNdO2 / R-3m (166) / materials id 754158
Description/Abstract:
Ab-initio phonon calculation for KNdO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KNdO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Rb3Sb2Au3 / R-3m (166) / materials id 9274
Description/Abstract:
Ab-initio phonon calculation for Rb3Sb2Au3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Phonon
,
R-3m (166)
, and
Rb3Sb2Au3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Sr2IN / R-3m (166) / materials id 569677
Description/Abstract:
Ab-initio phonon calculation for Sr2IN / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
R-3m (166)
, and
Sr2IN
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for K5CuSb2 / R-3m (166) / materials id 27999
Description/Abstract:
Ab-initio phonon calculation for K5CuSb2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
K5CuSb2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for KNdTe2 / R-3m (166) / materials id 11740
Description/Abstract:
Ab-initio phonon calculation for KNdTe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
KNdTe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for Li4NCl / R-3m (166) / materials id 29149
Description/Abstract:
Ab-initio phonon calculation for Li4NCl / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Li4NCl
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for RbPt2Se3 / R-3m (166) / materials id 14797
Description/Abstract:
Ab-initio phonon calculation for RbPt2Se3 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Phonon
,
R-3m (166)
, and
RbPt2Se3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for KYTe2 / R-3m (166) / materials id 16763
Description/Abstract:
Ab-initio phonon calculation for KYTe2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KYTe2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for CaHgO2 / R-3m (166) / materials id 7041
Description/Abstract:
Ab-initio phonon calculation for CaHgO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CaHgO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for CdI2 / R-3m (166) / materials id 573608
Description/Abstract:
Ab-initio phonon calculation for CdI2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CdI2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for Rb3B12H12Br / R-3m (166) / materials id 24796
Description/Abstract:
Ab-initio phonon calculation for Rb3B12H12Br / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Phonon
,
R-3m (166)
, and
Rb3B12H12Br
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for Bi2Te2S / R-3m (166) / materials id 27910
Description/Abstract:
Ab-initio phonon calculation for Bi2Te2S / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Bi2Te2S
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for KAsF6 / R-3m (166) / materials id 7569
Description/Abstract:
Ab-initio phonon calculation for KAsF6 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KAsF6
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
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