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Ab-initio phonon calculation for Na2Bi4O7 / C2/c (15) / materials id 780246
Description/Abstract:
Ab-initio phonon calculation for Na2Bi4O7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Na2Bi4O7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for YNbO4 / C2/c (15) / materials id 5387
Description/Abstract:
Ab-initio phonon calculation for YNbO4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/c (15)
,
Phonon
, and
YNbO4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for BaLi2P2O7 / C2/c (15) / materials id 6175
Description/Abstract:
Ab-initio phonon calculation for BaLi2P2O7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
BaLi2P2O7
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Li2SnP2O7 / C2/c (15) / materials id 27033
Description/Abstract:
Ab-initio phonon calculation for Li2SnP2O7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Li2SnP2O7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Cs4Zr3S14 / C2/c (15) / materials id 680246
Description/Abstract:
Ab-initio phonon calculation for Cs4Zr3S14 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Cs4Zr3S14
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Pr3Si2S8Cl / C2/c (15) / materials id 556179
Description/Abstract:
Ab-initio phonon calculation for Pr3Si2S8Cl / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/c (15)
,
Phonon
, and
Pr3Si2S8Cl
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for HgPSe3 / C2/c (15) / materials id 7293
Description/Abstract:
Ab-initio phonon calculation for HgPSe3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
HgPSe3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Cs3LaCl6 / C2/c (15) / materials id 582080
Description/Abstract:
Ab-initio phonon calculation for Cs3LaCl6 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Cs3LaCl6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Ca3(GaN2)2 / C2/c (15) / materials id 571162
Description/Abstract:
Ab-initio phonon calculation for Ca3(GaN2)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/c (15)
,
Ca3(GaN2)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Rb2AgAu3I8 / C2/c (15) / materials id 570536
Description/Abstract:
Ab-initio phonon calculation for Rb2AgAu3I8 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/c (15)
,
Phonon
, and
Rb2AgAu3I8
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for SbO2F / C2/c (15) / materials id 752753
Description/Abstract:
Ab-initio phonon calculation for SbO2F / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/c (15)
,
Phonon
, and
SbO2F
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
27/05/2023
Ab-initio phonon calculation for Na4Ti5O12 / C2/c (15) / materials id 760184
Description/Abstract:
Ab-initio phonon calculation for Na4Ti5O12 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Na4Ti5O12
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Cs3Bi2Br9 / C2/c (15) / materials id 680674
Description/Abstract:
Ab-initio phonon calculation for Cs3Bi2Br9 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Cs3Bi2Br9
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaP4N7 / C2/c (15) / materials id 29598
Description/Abstract:
Ab-initio phonon calculation for NaP4N7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
NaP4N7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbCa(H2N)3 / C2/c (15) / materials id 696329
Description/Abstract:
Ab-initio phonon calculation for RbCa(H2N)3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/c (15)
,
Phonon
, and
RbCa(H2N)3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for SiO2 / C2/c (15) / materials id 12787
Description/Abstract:
Ab-initio phonon calculation for SiO2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
C2/c (15)
,
Phonon
, and
SiO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CaGe2O5 / C2/c (15) / materials id 3707
Description/Abstract:
Ab-initio phonon calculation for CaGe2O5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
CaGe2O5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Tl2Te / C2/c (15) / materials id 582753
Description/Abstract:
Ab-initio phonon calculation for Tl2Te / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/c (15)
,
Phonon
, and
Tl2Te
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ZnH2SeO5 / C2/c (15) / materials id 23969
Description/Abstract:
Ab-initio phonon calculation for ZnH2SeO5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Phonon
, and
ZnH2SeO5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NdTaO4 / C2/c (15) / materials id 4718
Description/Abstract:
Ab-initio phonon calculation for NdTaO4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
NdTaO4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ta2Zn3O8 / C2/c (15) / materials id 28251
Description/Abstract:
Ab-initio phonon calculation for Ta2Zn3O8 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Phonon
, and
Ta2Zn3O8
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for MgSiO3 / C2/c (15) / materials id 4321
Description/Abstract:
Ab-initio phonon calculation for MgSiO3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
MgSiO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for PrAl3(BO3)4 / C2/c (15) / materials id 556804
Description/Abstract:
Ab-initio phonon calculation for PrAl3(BO3)4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
Phonon
, and
PrAl3(BO3)4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for La(BO2)3 / C2/c (15) / materials id 4658
Description/Abstract:
Ab-initio phonon calculation for La(BO2)3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
La(BO2)3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ho3Se3N / C2/c (15) / materials id 607806
Description/Abstract:
Ab-initio phonon calculation for Ho3Se3N / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
Ho3Se3N
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2BeB2O5 / C2/c (15) / materials id 16737
Description/Abstract:
Ab-initio phonon calculation for Na2BeB2O5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Na2BeB2O5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaIn(SiO3)2 / C2/c (15) / materials id 6333
Description/Abstract:
Ab-initio phonon calculation for NaIn(SiO3)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
NaIn(SiO3)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LaNbO4 / C2/c (15) / materials id 542724
Description/Abstract:
Ab-initio phonon calculation for LaNbO4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
LaNbO4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Dy2Te4O11 / C2/c (15) / materials id 510342
Description/Abstract:
Ab-initio phonon calculation for Dy2Te4O11 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Dy2Te4O11
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na4Li5(BO3)3 / C2/c (15) / materials id 558455
Description/Abstract:
Ab-initio phonon calculation for Na4Li5(BO3)3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
C2/c (15)
,
Na4Li5(BO3)3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiHo3Ge2(O4F)2 / C2/c (15) / materials id 561095
Description/Abstract:
Ab-initio phonon calculation for LiHo3Ge2(O4F)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
C2/c (15)
,
LiHo3Ge2(O4F)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K2PaF7 / C2/c (15) / materials id 542445
Description/Abstract:
Ab-initio phonon calculation for K2PaF7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
K2PaF7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ba7B4Se13 / C2/c (15) / materials id 583221
Description/Abstract:
Ab-initio phonon calculation for Ba7B4Se13 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ba7B4Se13
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Th2Cu(PO4)3 / C2/c (15) / materials id 6698
Description/Abstract:
Ab-initio phonon calculation for Th2Cu(PO4)3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
Phonon
, and
Th2Cu(PO4)3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaPr2S2O8F3 / C2/c (15) / materials id 560673
Description/Abstract:
Ab-initio phonon calculation for NaPr2S2O8F3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
NaPr2S2O8F3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2NbAsO6 / C2/c (15) / materials id 559968
Description/Abstract:
Ab-initio phonon calculation for Na2NbAsO6 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Na2NbAsO6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Mg2NiH4 / C2/c (15) / materials id 697331
Description/Abstract:
Ab-initio phonon calculation for Mg2NiH4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
Mg2NiH4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiAgF4 / C2/c (15) / materials id 758054
Description/Abstract:
Ab-initio phonon calculation for LiAgF4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
LiAgF4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2Zn(SiO3)2 / C2/c (15) / materials id 558580
Description/Abstract:
Ab-initio phonon calculation for Na2Zn(SiO3)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
C2/c (15)
,
Na2Zn(SiO3)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NdAl3(BO3)4 / C2/c (15) / materials id 6535
Description/Abstract:
Ab-initio phonon calculation for NdAl3(BO3)4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
NdAl3(BO3)4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsGaS2 / C2/c (15) / materials id 5038
Description/Abstract:
Ab-initio phonon calculation for CsGaS2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
CsGaS2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2ZnGaF7 / C2/c (15) / materials id 15547
Description/Abstract:
Ab-initio phonon calculation for Na2ZnGaF7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Na2ZnGaF7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Mg(GaS2)2 / C2/c (15) / materials id 667323
Description/Abstract:
Ab-initio phonon calculation for Mg(GaS2)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Mg(GaS2)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for HoTaO4 / C2/c (15) / materials id 4344
Description/Abstract:
Ab-initio phonon calculation for HoTaO4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
HoTaO4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaAl(SiO3)2 / C2/c (15) / materials id 6124
Description/Abstract:
Ab-initio phonon calculation for NaAl(SiO3)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
NaAl(SiO3)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ag3AsS3 / C2/c (15) / materials id 561620
Description/Abstract:
Ab-initio phonon calculation for Ag3AsS3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ag3AsS3
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsTaI6 / C2/c (15) / materials id 606510
Description/Abstract:
Ab-initio phonon calculation for CsTaI6 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
CsTaI6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaBeO2 / C2/c (15) / materials id 753443
Description/Abstract:
Ab-initio phonon calculation for NaBeO2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
NaBeO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Hg3(TeI)2 / C2/c (15) / materials id 28579
Description/Abstract:
Ab-initio phonon calculation for Hg3(TeI)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Hg3(TeI)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K3Bi5(PO4)6 / C2/c (15) / materials id 565692
Description/Abstract:
Ab-initio phonon calculation for K3Bi5(PO4)6 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
K3Bi5(PO4)6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Ba3(GaS3)2 / C2/c (15) / materials id 29302
Description/Abstract:
Ab-initio phonon calculation for Ba3(GaS3)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ba3(GaS3)2
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CsAuSe3 / C2/c (15) / materials id 567913
Description/Abstract:
Ab-initio phonon calculation for CsAuSe3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
CsAuSe3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for OsO4 / C2/c (15) / materials id 540783
Description/Abstract:
Ab-initio phonon calculation for OsO4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
C2/c (15)
,
OsO4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Li2TiO3 / C2/c (15) / materials id 36864
Description/Abstract:
Ab-initio phonon calculation for Li2TiO3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
Li2TiO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for AlTlF4 / C2/c (15) / materials id 3751
Description/Abstract:
Ab-initio phonon calculation for AlTlF4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
AlTlF4
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Sm(BO2)3 / C2/c (15) / materials id 11709
Description/Abstract:
Ab-initio phonon calculation for Sm(BO2)3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Phonon
, and
Sm(BO2)3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2CaH10C2O11 / C2/c (15) / materials id 24229
Description/Abstract:
Ab-initio phonon calculation for Na2CaH10C2O11 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
C2/c (15)
,
Na2CaH10C2O11
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for NaSc(SiO3)2 / C2/c (15) / materials id 7074
Description/Abstract:
Ab-initio phonon calculation for NaSc(SiO3)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
NaSc(SiO3)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for TiSO5 / C2/c (15) / materials id 505270
Description/Abstract:
Ab-initio phonon calculation for TiSO5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/c (15)
,
Phonon
, and
TiSO5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Nd(BO2)3 / C2/c (15) / materials id 3615
Description/Abstract:
Ab-initio phonon calculation for Nd(BO2)3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Nd(BO2)3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for SrSn(PO4)2 / C2/c (15) / materials id 862718
Description/Abstract:
Ab-initio phonon calculation for SrSn(PO4)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/c (15)
,
Phonon
, and
SrSn(PO4)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Bi2OF4 / C2/c (15) / materials id 753309
Description/Abstract:
Ab-initio phonon calculation for Bi2OF4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Bi2OF4
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Er2GeO5 / C2/c (15) / materials id 774547
Description/Abstract:
Ab-initio phonon calculation for Er2GeO5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
Er2GeO5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K3Dy(AsS4)2 / C2/c (15) / materials id 866661
Description/Abstract:
Ab-initio phonon calculation for K3Dy(AsS4)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
K3Dy(AsS4)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb4P2Se9 / C2/c (15) / materials id 569862
Description/Abstract:
Ab-initio phonon calculation for Rb4P2Se9 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Phonon
, and
Rb4P2Se9
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BaSc2O4 / C2/c (15) / materials id 3564
Description/Abstract:
Ab-initio phonon calculation for BaSc2O4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
BaSc2O4
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for BaH4(IO)2 / C2/c (15) / materials id 24090
Description/Abstract:
Ab-initio phonon calculation for BaH4(IO)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
BaH4(IO)2
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for PaCl5 / C2/c (15) / materials id 27436
Description/Abstract:
Ab-initio phonon calculation for PaCl5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
C2/c (15)
,
PaCl5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Lu2GeO5 / C2/c (15) / materials id 768388
Description/Abstract:
Ab-initio phonon calculation for Lu2GeO5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
Lu2GeO5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Li4Ti5O12 / C2/c (15) / materials id 685194
Description/Abstract:
Ab-initio phonon calculation for Li4Ti5O12 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Li4Ti5O12
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for KIn(GeO3)2 / C2/c (15) / materials id 8709
Description/Abstract:
Ab-initio phonon calculation for KIn(GeO3)2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/c (15)
,
KIn(GeO3)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Sr2AlH7 / C2/c (15) / materials id 697977
Description/Abstract:
Ab-initio phonon calculation for Sr2AlH7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
Phonon
, and
Sr2AlH7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for PdSe2O5 / C2/c (15) / materials id 4649
Description/Abstract:
Ab-initio phonon calculation for PdSe2O5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
PdSe2O5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Li6Zr2O7 / C2/c (15) / materials id 5418
Description/Abstract:
Ab-initio phonon calculation for Li6Zr2O7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Li6Zr2O7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for TbLi(PO3)4 / C2/c (15) / materials id 18194
Description/Abstract:
Ab-initio phonon calculation for TbLi(PO3)4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/c (15)
,
Phonon
, and
TbLi(PO3)4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for La3CBr5 / C2/c (15) / materials id 568484
Description/Abstract:
Ab-initio phonon calculation for La3CBr5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
La3CBr5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Na2PtO3 / C2/c (15) / materials id 557450
Description/Abstract:
Ab-initio phonon calculation for Na2PtO3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
Na2PtO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiSi2BiO6 / C2/c (15) / materials id 759680
Description/Abstract:
Ab-initio phonon calculation for LiSi2BiO6 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
LiSi2BiO6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Tl2Ge2S5 / C2/c (15) / materials id 12307
Description/Abstract:
Ab-initio phonon calculation for Tl2Ge2S5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Phonon
, and
Tl2Ge2S5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Er2Te4O11 / C2/c (15) / materials id 581795
Description/Abstract:
Ab-initio phonon calculation for Er2Te4O11 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Er2Te4O11
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for CaGa4O7 / C2/c (15) / materials id 17914
Description/Abstract:
Ab-initio phonon calculation for CaGa4O7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
CaGa4O7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K4UC3O11 / C2/c (15) / materials id 6194
Description/Abstract:
Ab-initio phonon calculation for K4UC3O11 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
K4UC3O11
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for LiPr2C2N4F3 / C2/c (15) / materials id 561257
Description/Abstract:
Ab-initio phonon calculation for LiPr2C2N4F3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
LiPr2C2N4F3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Rb2SrP2O7 / C2/c (15) / materials id 14354
Description/Abstract:
Ab-initio phonon calculation for Rb2SrP2O7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Phonon
, and
Rb2SrP2O7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for P2Pb3O8 / C2/c (15) / materials id 505799
Description/Abstract:
Ab-initio phonon calculation for P2Pb3O8 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
P2Pb3O8
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for BaYF5 / C2/c (15) / materials id 752675
Description/Abstract:
Ab-initio phonon calculation for BaYF5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
BaYF5
,
C2/c (15)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CaTiSiO5 / C2/c (15) / materials id 6440
Description/Abstract:
Ab-initio phonon calculation for CaTiSiO5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
CaTiSiO5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Rb4Hf3S14 / C2/c (15) / materials id 542012
Description/Abstract:
Ab-initio phonon calculation for Rb4Hf3S14 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Phonon
, and
Rb4Hf3S14
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for La2SO6 / C2/c (15) / materials id 4078
Description/Abstract:
Ab-initio phonon calculation for La2SO6 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
La2SO6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for PrSc3(BO3)4 / C2/c (15) / materials id 18677
Description/Abstract:
Ab-initio phonon calculation for PrSc3(BO3)4 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
Phonon
, and
PrSc3(BO3)4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for K3Ta2Ag3Se8 / C2/c (15) / materials id 582161
Description/Abstract:
Ab-initio phonon calculation for K3Ta2Ag3Se8 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
C2/c (15)
,
K3Ta2Ag3Se8
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Na2B2Se7 / C2/c (15) / materials id 5004
Description/Abstract:
Ab-initio phonon calculation for Na2B2Se7 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Na2B2Se7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for CsAs3O8 / C2/c (15) / materials id 554229
Description/Abstract:
Ab-initio phonon calculation for CsAs3O8 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
C2/c (15)
,
CsAs3O8
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for NaErO2 / C2/c (15) / materials id 5586
Description/Abstract:
Ab-initio phonon calculation for NaErO2 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
NaErO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Cd2P3I / C2/c (15) / materials id 29244
Description/Abstract:
Ab-initio phonon calculation for Cd2P3I / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
Cd2P3I
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Hg2As3Br / C2/c (15) / materials id 28899
Description/Abstract:
Ab-initio phonon calculation for Hg2As3Br / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Hg2As3Br
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for K2Ge2PbS6 / C2/c (15) / materials id 561132
Description/Abstract:
Ab-initio phonon calculation for K2Ge2PbS6 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
K2Ge2PbS6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for RbNaTiO3 / C2/c (15) / materials id 556185
Description/Abstract:
Ab-initio phonon calculation for RbNaTiO3 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/c (15)
,
Phonon
, and
RbNaTiO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Y2HfO5 / C2/c (15) / materials id 753917
Description/Abstract:
Ab-initio phonon calculation for Y2HfO5 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
C2/c (15)
,
Phonon
, and
Y2HfO5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for Sm2Te4O11 / C2/c (15) / materials id 3073
Description/Abstract:
Ab-initio phonon calculation for Sm2Te4O11 / C2/c (15) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
C2/c (15)
,
Phonon
, and
Sm2Te4O11
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
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