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MDR phonon calculation database
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Ab-initio phonon calculation for RbMgF3 / Pm-3m (221) / materials id 8402
Ab-initio phonon calculation for K2MgCl4 / I4/mmm (139) / materials id 27207
Ab-initio phonon calculation for AlSb / F-43m (216) / materials id 2624
Ab-initio phonon calculation for LiAsF6 / R-3 (148) / materials id 9144
Ab-initio phonon calculation for Nb2Cd2O7 / Fd-3m (227) / materials id 5472
Ab-initio phonon calculation for Ba3Y2F12 / P4/mbm (127) / materials id 752420
Ab-initio phonon calculation for BPO4 / P3_121 (152) / materials id 11653
Ab-initio phonon calculation for La3Si2S8I / C2/c (15) / materials id 23090
Ab-initio phonon calculation for Rb2CdO2 / Pbcn (60) / materials id 28364
Ab-initio phonon calculation for MgTe2O5 / Pbcn (60) / materials id 5746
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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
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MEXT
10,034
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VASP
10,034
phonopy
10,034
spglib
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