Skip to Content
Toggle navigation
Home
About
Help
Contact
Login
Search MDR
Go
Search Constraints
Start Over
Filtering by:
Publisher
NIMS
Remove constraint Publisher: NIMS
« Previous
|
1,011
-
1,020
of
10,145
|
Next »
Sort by relevance
relevance
date uploaded ▼
date uploaded ▲
date modified ▼
date modified ▲
Number of results to display per page
10 per page
10
per page
20
per page
50
per page
100
per page
View results as:
List
Gallery
Masonry
Slideshow
Search Results
Ab-initio phonon calculation for TlZnAsO4 / P2_1 (4) / materials id 18578
Description/Abstract:
Ab-initio phonon calculation for TlZnAsO4 / P2_1 (4) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
P2_1 (4)
,
Phonon
, and
TlZnAsO4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Cs3Zr7BCl20 / R-3c (167) / materials id 567781
Description/Abstract:
Ab-initio phonon calculation for Cs3Zr7BCl20 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Cs3Zr7BCl20
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Hg3SbAsS3 / P2_1/c (14) / materials id 554950
Description/Abstract:
Ab-initio phonon calculation for Hg3SbAsS3 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
Hg3SbAsS3
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K5SnAs3 / P2_1/c (14) / materials id 16989
Description/Abstract:
Ab-initio phonon calculation for K5SnAs3 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and phon...
Keyword:
K5SnAs3
,
P2_1/c (14)
, 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 CsAs4F13 / I-4 (82) / materials id 30927
Description/Abstract:
Ab-initio phonon calculation for CsAs4F13 / I-4 (82) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
CsAs4F13
,
I-4 (82)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Nd2TeO2 / I4/mmm (139) / materials id 5459
Description/Abstract:
Ab-initio phonon calculation for Nd2TeO2 / I4/mmm (139) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
I4/mmm (139)
,
Nd2TeO2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for Li8TiS6 / P6_3cm (185) / materials id 753546
Description/Abstract:
Ab-initio phonon calculation for Li8TiS6 / P6_3cm (185) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Li8TiS6
,
P6_3cm (185)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for K2Hg2SCl4O3 / P2_1/m (11) / materials id 559061
Description/Abstract:
Ab-initio phonon calculation for K2Hg2SCl4O3 / P2_1/m (11) Phonon band structure, phonon DOS, thermal properties at constant volume, and ...
Keyword:
K2Hg2SCl4O3
,
P2_1/m (11)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
Ab-initio phonon calculation for PHN2 / P2_12_12_1 (19) / materials id 697139
Description/Abstract:
Ab-initio phonon calculation for PHN2 / P2_12_12_1 (19) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
P2_12_12_1 (19)
,
PHN2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
26/05/2023
« Previous
Next »
1
2
…
98
99
100
101
102
103
104
105
106
…
1,014
1,015
Toggle facets
Limit your search
Type of work
Dataset
10,144
Publication
1
Collection
MDR phonon calculation database
10,034
Lattice thermal conductivity calculation datasets for 103 binary compounds by finite displacement method
103
PoLyInfo Knowledge Collection
2
The history of DICE and NIMS Digital Library
1
Keyword
Phonon
10,137
P2_1/c (14)
1,072
Pnma (62)
839
C2/c (15)
599
C2/m (12)
368
more
Keywords
»
Language
Japanese
1
Publisher
NIMS
[remove]
10,145
Resource type
Dataset
10,144
Presentation
1
Visibility
open
10,145
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
10,145
Data origin
simulation
10,034
simulations
103
experiment
2
other
2
others
2
more
Data origins
»
Characterization methods
spectroscopy -- x-ray photoelectron spectroscopy
2
Author
Atsushi Togo
10,137
Koichi Sakamoto
2
Masashi Ishii
2
SUMIYA, Masatomo
2
Akira Suzuki
1
more
Authors
»
Instrument manufacturer
Rikenkeiki
2
Funder
MEXT
10,034
Software
VASP
10,137
phonopy
10,137
spglib
10,137
phono3py
103