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MDR phonon calculation database
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Ab-initio phonon calculation for Li3In(BO3)2 / P2_1/c (14) / materials id 556799
Ab-initio phonon calculation for Si / P6_3/mmc (194) / materials id 165
Ab-initio phonon calculation for BaS3 / P2_12_12 (18) / materials id 556296
Ab-initio phonon calculation for Li3GaSiO5 / Pna2_1 (33) / materials id 16996
Ab-initio phonon calculation for In(PO3)3 / Cc (9) / materials id 14535
Ab-initio phonon calculation for Y3TaO7 / C222_1 (20) / materials id 11321
Ab-initio phonon calculation for K2Ga2As3 / P2_1/c (14) / materials id 15432
Ab-initio phonon calculation for Sb6Pb6S17 / P2_12_12 (18) / materials id 630376
Ab-initio phonon calculation for Nd2Pt2O7 / Fd-3m (227) / materials id 9765
Ab-initio phonon calculation for LiDyS2 / I4_1/amd (141) / materials id 33667
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Type of work
Dataset
10,034
Collection
MDR phonon calculation database
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10,034
Keyword
Phonon
10,034
P2_1/c (14)
1,072
Pnma (62)
839
C2/c (15)
599
C2/m (12)
368
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NIMS
10,034
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Dataset
10,034
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open
10,034
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
10,034
Data origin
simulation
10,034
Author
Atsushi Togo
10,034
Funder
MEXT
10,034
Software
VASP
10,034
phonopy
10,034
spglib
10,034