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Immm (71)
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Ab-initio phonon calculation for CsLi2Cl3 / Immm (71) / materials id 569117
Description/Abstract:
Ab-initio phonon calculation for CsLi2Cl3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
CsLi2Cl3
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K2Li14Pb3O14 / Immm (71) / materials id 504806
Description/Abstract:
Ab-initio phonon calculation for K2Li14Pb3O14 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Immm (71)
,
K2Li14Pb3O14
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for ThNb4O12 / Immm (71) / materials id 862893
Description/Abstract:
Ab-initio phonon calculation for ThNb4O12 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Immm (71)
,
Phonon
, and
ThNb4O12
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for RbO / Immm (71) / materials id 7895
Description/Abstract:
Ab-initio phonon calculation for RbO / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Immm (71)
,
Phonon
, and
RbO
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
25/05/2023
Ab-initio phonon calculation for LiLa2HO3 / Immm (71) / materials id 24148
Description/Abstract:
Ab-initio phonon calculation for LiLa2HO3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Immm (71)
,
LiLa2HO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Rb2Li14Pb3O14 / Immm (71) / materials id 504810
Description/Abstract:
Ab-initio phonon calculation for Rb2Li14Pb3O14 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
Immm (71)
,
Phonon
, and
Rb2Li14Pb3O14
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for Ba6Mg7H26 / Immm (71) / materials id 697671
Description/Abstract:
Ab-initio phonon calculation for Ba6Mg7H26 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ba6Mg7H26
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for CsS / Immm (71) / materials id 29266
Description/Abstract:
Ab-initio phonon calculation for CsS / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
CsS
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
24/05/2023
Ab-initio phonon calculation for CsLi2Br3 / Immm (71) / materials id 606680
Description/Abstract:
Ab-initio phonon calculation for CsLi2Br3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
CsLi2Br3
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for TlPS3 / Immm (71) / materials id 8249
Description/Abstract:
Ab-initio phonon calculation for TlPS3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Immm (71)
,
Phonon
, and
TlPS3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for K2PtSe2 / Immm (71) / materials id 8621
Description/Abstract:
Ab-initio phonon calculation for K2PtSe2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
K2PtSe2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for K2PdO2 / Immm (71) / materials id 540584
Description/Abstract:
Ab-initio phonon calculation for K2PdO2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Immm (71)
,
K2PdO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
23/05/2023
Ab-initio phonon calculation for K2PtS2 / Immm (71) / materials id 7928
Description/Abstract:
Ab-initio phonon calculation for K2PtS2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Immm (71)
,
K2PtS2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for ZnH4(BrO)2 / Immm (71) / materials id 643060
Description/Abstract:
Ab-initio phonon calculation for ZnH4(BrO)2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Immm (71)
,
Phonon
, and
ZnH4(BrO)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for CsPS3 / Immm (71) / materials id 504838
Description/Abstract:
Ab-initio phonon calculation for CsPS3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CsPS3
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Li5Br2N / Immm (71) / materials id 29025
Description/Abstract:
Ab-initio phonon calculation for Li5Br2N / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
Li5Br2N
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for LiC / Immm (71) / materials id 1378
Description/Abstract:
Ab-initio phonon calculation for LiC / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Immm (71)
,
LiC
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for BaSrTa2O7 / Immm (71) / materials id 559151
Description/Abstract:
Ab-initio phonon calculation for BaSrTa2O7 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
BaSrTa2O7
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for La2UO6 / Immm (71) / materials id 760513
Description/Abstract:
Ab-initio phonon calculation for La2UO6 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Immm (71)
,
La2UO6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Rb(ThSe3)2 / Immm (71) / materials id 9523
Description/Abstract:
Ab-initio phonon calculation for Rb(ThSe3)2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Immm (71)
,
Phonon
, and
Rb(ThSe3)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Ta(ICl)2 / Immm (71) / materials id 28683
Description/Abstract:
Ab-initio phonon calculation for Ta(ICl)2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Immm (71)
,
Phonon
, and
Ta(ICl)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Na2PtO2 / Immm (71) / materials id 22313
Description/Abstract:
Ab-initio phonon calculation for Na2PtO2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
Na2PtO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for K2Te2Pt / Immm (71) / materials id 8623
Description/Abstract:
Ab-initio phonon calculation for K2Te2Pt / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
K2Te2Pt
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
18/05/2023
Ab-initio phonon calculation for Na2Pd3O4 / Immm (71) / materials id 27562
Description/Abstract:
Ab-initio phonon calculation for Na2Pd3O4 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Immm (71)
,
Na2Pd3O4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
17/05/2023
Ab-initio phonon calculation for Rb2PtSe2 / Immm (71) / materials id 8622
Description/Abstract:
Ab-initio phonon calculation for Rb2PtSe2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Immm (71)
,
Phonon
, and
Rb2PtSe2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Li2PdO2 / Immm (71) / materials id 7608
Description/Abstract:
Ab-initio phonon calculation for Li2PdO2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
Li2PdO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Li5BiS4 / Immm (71) / materials id 755139
Description/Abstract:
Ab-initio phonon calculation for Li5BiS4 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
Li5BiS4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for OsCl2O / Immm (71) / materials id 29133
Description/Abstract:
Ab-initio phonon calculation for OsCl2O / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Immm (71)
,
OsCl2O
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Rb2PtS2 / Immm (71) / materials id 7929
Description/Abstract:
Ab-initio phonon calculation for Rb2PtS2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
Phonon
, and
Rb2PtS2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Ba6Mg7F26 / Immm (71) / materials id 18549
Description/Abstract:
Ab-initio phonon calculation for Ba6Mg7F26 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ba6Mg7F26
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for RbS / Immm (71) / materials id 558071
Description/Abstract:
Ab-initio phonon calculation for RbS / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw...
Keyword:
Immm (71)
,
Phonon
, and
RbS
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for SiO2 / Immm (71) / materials id 15078
Description/Abstract:
Ab-initio phonon calculation for SiO2 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Immm (71)
,
Phonon
, and
SiO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for KSrNb2O6F / Immm (71) / materials id 579086
Description/Abstract:
Ab-initio phonon calculation for KSrNb2O6F / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Immm (71)
,
KSrNb2O6F
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for LiNd2HO3 / Immm (71) / materials id 24150
Description/Abstract:
Ab-initio phonon calculation for LiNd2HO3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Immm (71)
,
LiNd2HO3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Ba3Sr4O7 / Immm (71) / materials id 760515
Description/Abstract:
Ab-initio phonon calculation for Ba3Sr4O7 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Ba3Sr4O7
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for RuCl2O / Immm (71) / materials id 29132
Description/Abstract:
Ab-initio phonon calculation for RuCl2O / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Immm (71)
,
Phonon
, and
RuCl2O
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for Sr2LaTa3O11 / Immm (71) / materials id 557028
Description/Abstract:
Ab-initio phonon calculation for Sr2LaTa3O11 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Immm (71)
,
Phonon
, and
Sr2LaTa3O11
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for MgZn2H12(BrO)6 / Immm (71) / materials id 697121
Description/Abstract:
Ab-initio phonon calculation for MgZn2H12(BrO)6 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
Immm (71)
,
MgZn2H12(BrO)6
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
Ab-initio phonon calculation for KPS3 / Immm (71) / materials id 8267
Description/Abstract:
Ab-initio phonon calculation for KPS3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Immm (71)
,
KPS3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for K2Li14Zr3O14 / Immm (71) / materials id 17208
Description/Abstract:
Ab-initio phonon calculation for K2Li14Zr3O14 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Immm (71)
,
K2Li14Zr3O14
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for RbPS3 / Immm (71) / materials id 556953
Description/Abstract:
Ab-initio phonon calculation for RbPS3 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Immm (71)
,
Phonon
, and
RbPS3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for Li5SbS4 / Immm (71) / materials id 768197
Description/Abstract:
Ab-initio phonon calculation for Li5SbS4 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Immm (71)
,
Li5SbS4
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
Ab-initio phonon calculation for CsAuF4 / Immm (71) / materials id 572767
Description/Abstract:
Ab-initio phonon calculation for CsAuF4 / Immm (71) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CsAuF4
,
Immm (71)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
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MDR phonon calculation database
43
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Immm (71)
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NIMS
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43
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Creative Commons BY Attribution 4.0 International
43
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43
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Atsushi Togo
43
Funder
MEXT
43
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VASP
43
phonopy
43
spglib
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