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
|
5,061
-
5,070
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 NaLuO2 / R-3m (166) / materials id 755311
Description/Abstract:
Ab-initio phonon calculation for NaLuO2 / R-3m (166) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon...
Keyword:
NaLuO2
,
Phonon
, and
R-3m (166)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for SrMgF4 / P2_1 (4) / materials id 561022
Description/Abstract:
Ab-initio phonon calculation for SrMgF4 / P2_1 (4) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
P2_1 (4)
,
Phonon
, and
SrMgF4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for CsMgI3 / P6_3/mmc (194) / materials id 29751
Description/Abstract:
Ab-initio phonon calculation for CsMgI3 / P6_3/mmc (194) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
CsMgI3
,
P6_3/mmc (194)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for La3Pt3O11 / Pn-3 (201) / materials id 768523
Description/Abstract:
Ab-initio phonon calculation for La3Pt3O11 / Pn-3 (201) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
La3Pt3O11
,
Phonon
, and
Pn-3 (201)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for IrF3 / R-3c (167) / materials id 2437
Description/Abstract:
Ab-initio phonon calculation for IrF3 / R-3c (167) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon r...
Keyword:
IrF3
,
Phonon
, and
R-3c (167)
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Pd(PbCl3)2 / P2_1/c (14) / materials id 28982
Description/Abstract:
Ab-initio phonon calculation for Pd(PbCl3)2 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
P2_1/c (14)
,
Pd(PbCl3)2
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Ga2S3 / Cc (9) / materials id 539
Description/Abstract:
Ab-initio phonon calculation for Ga2S3 / Cc (9) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon raw ...
Keyword:
Cc (9)
,
Ga2S3
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for SrNb2Bi2O9 / Cmc2_1 (36) / materials id 23614
Description/Abstract:
Ab-initio phonon calculation for SrNb2Bi2O9 / Cmc2_1 (36) Phonon band structure, phonon DOS, thermal properties at constant volume, and p...
Keyword:
Cmc2_1 (36)
,
Phonon
, and
SrNb2Bi2O9
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for K2SbF5 / Cmcm (63) / materials id 3379
Description/Abstract:
Ab-initio phonon calculation for K2SbF5 / Cmcm (63) Phonon band structure, phonon DOS, thermal properties at constant volume, and phonon ...
Keyword:
Cmcm (63)
,
K2SbF5
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Ho2Ge2O7 / C2/m (12) / materials id 753693
Description/Abstract:
Ab-initio phonon calculation for Ho2Ge2O7 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
C2/m (12)
,
Ho2Ge2O7
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
« Previous
Next »
1
2
…
503
504
505
506
507
508
509
510
511
…
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