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
|
5,081
-
5,090
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 KY(PSe3)2 / P2_12_12_1 (19) / materials id 571057
Description/Abstract:
Ab-initio phonon calculation for KY(PSe3)2 / P2_12_12_1 (19) Phonon band structure, phonon DOS, thermal properties at constant volume, an...
Keyword:
KY(PSe3)2
,
P2_12_12_1 (19)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Ti5(PO5)4 / P2_12_12_1 (19) / materials id 559530
Description/Abstract:
Ab-initio phonon calculation for Ti5(PO5)4 / P2_12_12_1 (19) Phonon band structure, phonon DOS, thermal properties at constant volume, an...
Keyword:
P2_12_12_1 (19)
,
Phonon
, and
Ti5(PO5)4
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for In2(PS3)3 / P2_1/c (14) / materials id 27753
Description/Abstract:
Ab-initio phonon calculation for In2(PS3)3 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and ph...
Keyword:
In2(PS3)3
,
P2_1/c (14)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Ba(GaSe2)2 / Cccm (66) / materials id 7841
Description/Abstract:
Ab-initio phonon calculation for Ba(GaSe2)2 / Cccm (66) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
Ba(GaSe2)2
,
Cccm (66)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Sr4Cu2O7 / P2_1/c (14) / materials id 766217
Description/Abstract:
Ab-initio phonon calculation for Sr4Cu2O7 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
P2_1/c (14)
,
Phonon
, and
Sr4Cu2O7
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Sr2C(NCl)2 / C2/m (12) / materials id 567655
Description/Abstract:
Ab-initio phonon calculation for Sr2C(NCl)2 / C2/m (12) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
C2/m (12)
,
Phonon
, and
Sr2C(NCl)2
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for ScSbPt / F-43m (216) / materials id 7173
Description/Abstract:
Ab-initio phonon calculation for ScSbPt / F-43m (216) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
F-43m (216)
,
Phonon
, and
ScSbPt
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for SbHO3 / I4_1/amd (141) / materials id 626182
Description/Abstract:
Ab-initio phonon calculation for SbHO3 / I4_1/amd (141) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
I4_1/amd (141)
,
Phonon
, and
SbHO3
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for Ba2YTaO6 / I4/m (87) / materials id 12385
Description/Abstract:
Ab-initio phonon calculation for Ba2YTaO6 / I4/m (87) Phonon band structure, phonon DOS, thermal properties at constant volume, and phono...
Keyword:
Ba2YTaO6
,
I4/m (87)
, and
Phonon
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
Ab-initio phonon calculation for TlPb2Cl5 / P2_1/c (14) / materials id 27283
Description/Abstract:
Ab-initio phonon calculation for TlPb2Cl5 / P2_1/c (14) Phonon band structure, phonon DOS, thermal properties at constant volume, and pho...
Keyword:
P2_1/c (14)
,
Phonon
, and
TlPb2Cl5
Resource Type:
Dataset
Data origin:
simulation
Author:
Atsushi Togo
Date Uploaded:
22/05/2023
« Previous
Next »
1
2
…
505
506
507
508
509
510
511
512
513
…
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