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1.
Ab-initio phonon calculation for K2BiF5 / Pnma (62) / materials id 561290
Description/Abstract:
Ab-initio phonon calculation for K2BiF5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
K2BiF5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
17/05/2023
2.
Ab-initio phonon calculation for CsBi3Se5 / Pnma (62) / materials id 567928
Description/Abstract:
Ab-initio phonon calculation for CsBi3Se5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
CsBi3Se5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
3.
Ab-initio phonon calculation for SrSi2(BO4)2 / Pnma (62) / materials id 6032
Description/Abstract:
Ab-initio phonon calculation for SrSi2(BO4)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Phonon
,
Pnma (62)
, and
SrSi2(BO4)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
4.
Ab-initio phonon calculation for BaB4O7 / Pnma (62) / materials id 556974
Description/Abstract:
Ab-initio phonon calculation for BaB4O7 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
BaB4O7
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
5.
Ab-initio phonon calculation for Nd4Te3N2 / Pnma (62) / materials id 570646
Description/Abstract:
Ab-initio phonon calculation for Nd4Te3N2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Nd4Te3N2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
6.
Ab-initio phonon calculation for Dy2Ge2O7 / Pnma (62) / materials id 773011
Description/Abstract:
Ab-initio phonon calculation for Dy2Ge2O7 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Dy2Ge2O7
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
7.
Ab-initio phonon calculation for La2Si4CN6 / Pnma (62) / materials id 866650
Description/Abstract:
Ab-initio phonon calculation for La2Si4CN6 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
La2Si4CN6
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
8.
Ab-initio phonon calculation for SrZrS3 / Pnma (62) / materials id 5193
Description/Abstract:
Ab-initio phonon calculation for SrZrS3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
SrZrS3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
9.
Ab-initio phonon calculation for NaYCO3F2 / Pnma (62) / materials id 558160
Description/Abstract:
Ab-initio phonon calculation for NaYCO3F2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
NaYCO3F2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
10.
Ab-initio phonon calculation for KClO3 / Pnma (62) / materials id 556084
Description/Abstract:
Ab-initio phonon calculation for KClO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
KClO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
11.
Ab-initio phonon calculation for Sr2BN2Cl / Pnma (62) / materials id 23131
Description/Abstract:
Ab-initio phonon calculation for Sr2BN2Cl / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
Sr2BN2Cl
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
12.
Ab-initio phonon calculation for CdSeO4 / Pnma (62) / materials id 779156
Description/Abstract:
Ab-initio phonon calculation for CdSeO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CdSeO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
13.
Ab-initio phonon calculation for BaDy2ZnO5 / Pnma (62) / materials id 6643
Description/Abstract:
Ab-initio phonon calculation for BaDy2ZnO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
BaDy2ZnO5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
14.
Ab-initio phonon calculation for CrSbSe3 / Pnma (62) / materials id 15236
Description/Abstract:
Ab-initio phonon calculation for CrSbSe3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CrSbSe3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
15.
Ab-initio phonon calculation for RbBaTaS4 / Pnma (62) / materials id 867884
Description/Abstract:
Ab-initio phonon calculation for RbBaTaS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
RbBaTaS4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
16.
Ab-initio phonon calculation for TlCdBr3 / Pnma (62) / materials id 28219
Description/Abstract:
Ab-initio phonon calculation for TlCdBr3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
TlCdBr3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
17.
Ab-initio phonon calculation for RbClO4 / Pnma (62) / materials id 28433
Description/Abstract:
Ab-initio phonon calculation for RbClO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
RbClO4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
18.
Ab-initio phonon calculation for Mg(SiB6)2 / Pnma (62) / materials id 567224
Description/Abstract:
Ab-initio phonon calculation for Mg(SiB6)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Mg(SiB6)2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
19.
Ab-initio phonon calculation for La2Se2O / Pnma (62) / materials id 752418
Description/Abstract:
Ab-initio phonon calculation for La2Se2O / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
La2Se2O
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
20.
Ab-initio phonon calculation for KBaPSe4 / Pnma (62) / materials id 18156
Description/Abstract:
Ab-initio phonon calculation for KBaPSe4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
KBaPSe4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
21.
Ab-initio phonon calculation for Pr2S3 / Pnma (62) / materials id 15179
Description/Abstract:
Ab-initio phonon calculation for Pr2S3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
Pnma (62)
, and
Pr2S3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
22.
Ab-initio phonon calculation for Na2S / Pnma (62) / materials id 556978
Description/Abstract:
Ab-initio phonon calculation for Na2S / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Na2S
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
23.
Ab-initio phonon calculation for Na2SO4 / Pnma (62) / materials id 505274
Description/Abstract:
Ab-initio phonon calculation for Na2SO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Na2SO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
24.
Ab-initio phonon calculation for NaLiTe / Pnma (62) / materials id 8754
Description/Abstract:
Ab-initio phonon calculation for NaLiTe / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
NaLiTe
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
25.
Ab-initio phonon calculation for CaSeO3 / Pnma (62) / materials id 754140
Description/Abstract:
Ab-initio phonon calculation for CaSeO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CaSeO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
26.
Ab-initio phonon calculation for LiCuS / Pnma (62) / materials id 753826
Description/Abstract:
Ab-initio phonon calculation for LiCuS / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
LiCuS
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
27.
Ab-initio phonon calculation for Rb2AgCl3 / Pnma (62) / materials id 29693
Description/Abstract:
Ab-initio phonon calculation for Rb2AgCl3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
Rb2AgCl3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
28.
Ab-initio phonon calculation for CaHfO3 / Pnma (62) / materials id 754853
Description/Abstract:
Ab-initio phonon calculation for CaHfO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CaHfO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
29.
Ab-initio phonon calculation for Rb3PS4 / Pnma (62) / materials id 16863
Description/Abstract:
Ab-initio phonon calculation for Rb3PS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
Rb3PS4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
30.
Ab-initio phonon calculation for GaHO2 / Pnma (62) / materials id 634326
Description/Abstract:
Ab-initio phonon calculation for GaHO2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
GaHO2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
31.
Ab-initio phonon calculation for Ca2BHN2 / Pnma (62) / materials id 24266
Description/Abstract:
Ab-initio phonon calculation for Ca2BHN2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ca2BHN2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
32.
Ab-initio phonon calculation for LuSeClO3 / Pnma (62) / materials id 23096
Description/Abstract:
Ab-initio phonon calculation for LuSeClO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
LuSeClO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
33.
Ab-initio phonon calculation for Mg2SiO4 / Pnma (62) / materials id 2895
Description/Abstract:
Ab-initio phonon calculation for Mg2SiO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Mg2SiO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
34.
Ab-initio phonon calculation for H3OF / Pnma (62) / materials id 27714
Description/Abstract:
Ab-initio phonon calculation for H3OF / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
H3OF
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
35.
Ab-initio phonon calculation for Rb2Cd3Se4 / Pnma (62) / materials id 16818
Description/Abstract:
Ab-initio phonon calculation for Rb2Cd3Se4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Phonon
,
Pnma (62)
, and
Rb2Cd3Se4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
36.
Ab-initio phonon calculation for CsLiSO4 / Pnma (62) / materials id 6597
Description/Abstract:
Ab-initio phonon calculation for CsLiSO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsLiSO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
37.
Ab-initio phonon calculation for TbGaO3 / Pnma (62) / materials id 756290
Description/Abstract:
Ab-initio phonon calculation for TbGaO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
TbGaO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
38.
Ab-initio phonon calculation for LuAlO3 / Pnma (62) / materials id 755574
Description/Abstract:
Ab-initio phonon calculation for LuAlO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
LuAlO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
39.
Ab-initio phonon calculation for KMnCl3 / Pnma (62) / materials id 23049
Description/Abstract:
Ab-initio phonon calculation for KMnCl3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
KMnCl3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
40.
Ab-initio phonon calculation for NdGaO3 / Pnma (62) / materials id 3196
Description/Abstract:
Ab-initio phonon calculation for NdGaO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
NdGaO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
41.
Ab-initio phonon calculation for Ca2GeO4 / Pnma (62) / materials id 560647
Description/Abstract:
Ab-initio phonon calculation for Ca2GeO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ca2GeO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
42.
Ab-initio phonon calculation for RbI3 / Pnma (62) / materials id 28328
Description/Abstract:
Ab-initio phonon calculation for RbI3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Phonon
,
Pnma (62)
, and
RbI3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
43.
Ab-initio phonon calculation for In2PbS4 / Pnma (62) / materials id 619279
Description/Abstract:
Ab-initio phonon calculation for In2PbS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
In2PbS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
44.
Ab-initio phonon calculation for Dy2TiO5 / Pnma (62) / materials id 770816
Description/Abstract:
Ab-initio phonon calculation for Dy2TiO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Dy2TiO5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
45.
Ab-initio phonon calculation for Y2HfS5 / Pnma (62) / materials id 16919
Description/Abstract:
Ab-initio phonon calculation for Y2HfS5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
Y2HfS5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
46.
Ab-initio phonon calculation for BaTm2ZnO5 / Pnma (62) / materials id 6250
Description/Abstract:
Ab-initio phonon calculation for BaTm2ZnO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
BaTm2ZnO5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
47.
Ab-initio phonon calculation for PbSO4 / Pnma (62) / materials id 3472
Description/Abstract:
Ab-initio phonon calculation for PbSO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
PbSO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
48.
Ab-initio phonon calculation for NaMgH3 / Pnma (62) / materials id 23730
Description/Abstract:
Ab-initio phonon calculation for NaMgH3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
NaMgH3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
49.
Ab-initio phonon calculation for KP4N7 / Pnma (62) / materials id 505495
Description/Abstract:
Ab-initio phonon calculation for KP4N7 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
KP4N7
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
50.
Ab-initio phonon calculation for SrSm2O4 / Pnma (62) / materials id 754414
Description/Abstract:
Ab-initio phonon calculation for SrSm2O4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
SrSm2O4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
51.
Ab-initio phonon calculation for Ba(CuTe)2 / Pnma (62) / materials id 30133
Description/Abstract:
Ab-initio phonon calculation for Ba(CuTe)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Ba(CuTe)2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
52.
Ab-initio phonon calculation for HoTeClO3 / Pnma (62) / materials id 559805
Description/Abstract:
Ab-initio phonon calculation for HoTeClO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
HoTeClO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
53.
Ab-initio phonon calculation for Y2Si2O7 / Pnma (62) / materials id 17404
Description/Abstract:
Ab-initio phonon calculation for Y2Si2O7 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
Y2Si2O7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
54.
Ab-initio phonon calculation for Ba3AlHO4 / Pnma (62) / materials id 707218
Description/Abstract:
Ab-initio phonon calculation for Ba3AlHO4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Ba3AlHO4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
55.
Ab-initio phonon calculation for K3Sm(BO3)2 / Pnma (62) / materials id 559574
Description/Abstract:
Ab-initio phonon calculation for K3Sm(BO3)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
K3Sm(BO3)2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
56.
Ab-initio phonon calculation for BaTeO3 / Pnma (62) / materials id 556021
Description/Abstract:
Ab-initio phonon calculation for BaTeO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
BaTeO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
57.
Ab-initio phonon calculation for SrCN2 / Pnma (62) / materials id 9167
Description/Abstract:
Ab-initio phonon calculation for SrCN2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
Phonon
,
Pnma (62)
, and
SrCN2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
58.
Ab-initio phonon calculation for Tm3TaO7 / Pnma (62) / materials id 779096
Description/Abstract:
Ab-initio phonon calculation for Tm3TaO7 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
Tm3TaO7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
59.
Ab-initio phonon calculation for CsSnI3 / Pnma (62) / materials id 27381
Description/Abstract:
Ab-initio phonon calculation for CsSnI3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CsSnI3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
60.
Ab-initio phonon calculation for HoF3 / Pnma (62) / materials id 561877
Description/Abstract:
Ab-initio phonon calculation for HoF3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
HoF3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
61.
Ab-initio phonon calculation for K4SnSe4 / Pnma (62) / materials id 18132
Description/Abstract:
Ab-initio phonon calculation for K4SnSe4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
K4SnSe4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
62.
Ab-initio phonon calculation for K2BeF4 / Pnma (62) / materials id 5185
Description/Abstract:
Ab-initio phonon calculation for K2BeF4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
K2BeF4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
63.
Ab-initio phonon calculation for K2ZnCl4 / Pnma (62) / materials id 653454
Description/Abstract:
Ab-initio phonon calculation for K2ZnCl4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
K2ZnCl4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
64.
Ab-initio phonon calculation for LuH2ClO2 / Pnma (62) / materials id 976349
Description/Abstract:
Ab-initio phonon calculation for LuH2ClO2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
LuH2ClO2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
65.
Ab-initio phonon calculation for AuSeBr / Pnma (62) / materials id 27199
Description/Abstract:
Ab-initio phonon calculation for AuSeBr / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
AuSeBr
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
66.
Ab-initio phonon calculation for SrSnO3 / Pnma (62) / materials id 2879
Description/Abstract:
Ab-initio phonon calculation for SrSnO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
SrSnO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
67.
Ab-initio phonon calculation for Ba(TmTe2)2 / Pnma (62) / materials id 18196
Description/Abstract:
Ab-initio phonon calculation for Ba(TmTe2)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ba(TmTe2)2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
68.
Ab-initio phonon calculation for Bi2PbS4 / Pnma (62) / materials id 641924
Description/Abstract:
Ab-initio phonon calculation for Bi2PbS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Bi2PbS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
69.
Ab-initio phonon calculation for Cs2DyCl5 / Pnma (62) / materials id 540695
Description/Abstract:
Ab-initio phonon calculation for Cs2DyCl5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cs2DyCl5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
70.
Ab-initio phonon calculation for CsTeF5 / Pnma (62) / materials id 541628
Description/Abstract:
Ab-initio phonon calculation for CsTeF5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
CsTeF5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
71.
Ab-initio phonon calculation for ZrSnS3 / Pnma (62) / materials id 17324
Description/Abstract:
Ab-initio phonon calculation for ZrSnS3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
ZrSnS3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
72.
Ab-initio phonon calculation for K2H2IrCl5O / Pnma (62) / materials id 23801
Description/Abstract:
Ab-initio phonon calculation for K2H2IrCl5O / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
K2H2IrCl5O
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
73.
Ab-initio phonon calculation for HoAlO3 / Pnma (62) / materials id 4891
Description/Abstract:
Ab-initio phonon calculation for HoAlO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
HoAlO3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
74.
Ab-initio phonon calculation for ZrO2 / Pnma (62) / materials id 755089
Description/Abstract:
Ab-initio phonon calculation for ZrO2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ra...
Keyword:
Phonon
,
Pnma (62)
, and
ZrO2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
75.
Ab-initio phonon calculation for Ag3AsSe3 / Pnma (62) / materials id 662599
Description/Abstract:
Ab-initio phonon calculation for Ag3AsSe3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Ag3AsSe3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
76.
Ab-initio phonon calculation for La3NbSe2(O2F)2 / Pnma (62) / materials id 558478
Description/Abstract:
Ab-initio phonon calculation for La3NbSe2(O2F)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and...
Keyword:
La3NbSe2(O2F)2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
77.
Ab-initio phonon calculation for Rb2PO3F / Pnma (62) / materials id 6160
Description/Abstract:
Ab-initio phonon calculation for Rb2PO3F / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
Rb2PO3F
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
78.
Ab-initio phonon calculation for YTa3O9 / Pnma (62) / materials id 850669
Description/Abstract:
Ab-initio phonon calculation for YTa3O9 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
YTa3O9
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
79.
Ab-initio phonon calculation for CsBr3 / Pnma (62) / materials id 27641
Description/Abstract:
Ab-initio phonon calculation for CsBr3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
CsBr3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
80.
Ab-initio phonon calculation for Cs2GaSb2 / Pnma (62) / materials id 29372
Description/Abstract:
Ab-initio phonon calculation for Cs2GaSb2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Cs2GaSb2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
81.
Ab-initio phonon calculation for TmAlO3 / Pnma (62) / materials id 756281
Description/Abstract:
Ab-initio phonon calculation for TmAlO3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
TmAlO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
82.
Ab-initio phonon calculation for Cs2WS4 / Pnma (62) / materials id 17361
Description/Abstract:
Ab-initio phonon calculation for Cs2WS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cs2WS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
83.
Ab-initio phonon calculation for Y2GeO5 / Pnma (62) / materials id 768814
Description/Abstract:
Ab-initio phonon calculation for Y2GeO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Phonon
,
Pnma (62)
, and
Y2GeO5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
84.
Ab-initio phonon calculation for Er2TiO5 / Pnma (62) / materials id 774567
Description/Abstract:
Ab-initio phonon calculation for Er2TiO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Er2TiO5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
85.
Ab-initio phonon calculation for Rb3ZnBr5 / Pnma (62) / materials id 505001
Description/Abstract:
Ab-initio phonon calculation for Rb3ZnBr5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
Rb3ZnBr5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
86.
Ab-initio phonon calculation for Ba9(AuO6)2 / Pnma (62) / materials id 28788
Description/Abstract:
Ab-initio phonon calculation for Ba9(AuO6)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ba9(AuO6)2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
87.
Ab-initio phonon calculation for DyCuS2 / Pnma (62) / materials id 555044
Description/Abstract:
Ab-initio phonon calculation for DyCuS2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
DyCuS2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
88.
Ab-initio phonon calculation for SrDy2O4 / Pnma (62) / materials id 556075
Description/Abstract:
Ab-initio phonon calculation for SrDy2O4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
SrDy2O4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
89.
Ab-initio phonon calculation for BaSi2 / Pnma (62) / materials id 1477
Description/Abstract:
Ab-initio phonon calculation for BaSi2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
BaSi2
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
90.
Ab-initio phonon calculation for Bi2Se3 / Pnma (62) / materials id 23164
Description/Abstract:
Ab-initio phonon calculation for Bi2Se3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Bi2Se3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
91.
Ab-initio phonon calculation for Tl3PSe4 / Pnma (62) / materials id 4160
Description/Abstract:
Ab-initio phonon calculation for Tl3PSe4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
Tl3PSe4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
92.
Ab-initio phonon calculation for Rb2BeF4 / Pnma (62) / materials id 3009
Description/Abstract:
Ab-initio phonon calculation for Rb2BeF4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Phonon
,
Pnma (62)
, and
Rb2BeF4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
93.
Ab-initio phonon calculation for Li3PS4 / Pnma (62) / materials id 985583
Description/Abstract:
Ab-initio phonon calculation for Li3PS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Li3PS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
94.
Ab-initio phonon calculation for Rb2CuCl3 / Pnma (62) / materials id 640053
Description/Abstract:
Ab-initio phonon calculation for Rb2CuCl3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Phonon
,
Pnma (62)
, and
Rb2CuCl3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
95.
Ab-initio phonon calculation for Ba2GeS4 / Pnma (62) / materials id 540805
Description/Abstract:
Ab-initio phonon calculation for Ba2GeS4 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ba2GeS4
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
15/05/2023
96.
Ab-initio phonon calculation for Sr(DyS2)2 / Pnma (62) / materials id 980666
Description/Abstract:
Ab-initio phonon calculation for Sr(DyS2)2 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
Phonon
,
Pnma (62)
, and
Sr(DyS2)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
97.
Ab-initio phonon calculation for Nd4GeO8 / Pnma (62) / materials id 559014
Description/Abstract:
Ab-initio phonon calculation for Nd4GeO8 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Nd4GeO8
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
98.
Ab-initio phonon calculation for LiCaN / Pnma (62) / materials id 31468
Description/Abstract:
Ab-initio phonon calculation for LiCaN / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
LiCaN
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
99.
Ab-initio phonon calculation for K2CuBr3 / Pnma (62) / materials id 571440
Description/Abstract:
Ab-initio phonon calculation for K2CuBr3 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
K2CuBr3
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
100.
Ab-initio phonon calculation for Ho2TiO5 / Pnma (62) / materials id 768605
Description/Abstract:
Ab-initio phonon calculation for Ho2TiO5 / Pnma (62) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
Ho2TiO5
,
Phonon
, and
Pnma (62)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
16/05/2023
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