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MDR phonon calculation database
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Ab-initio phonon calculation for CsSnBr3 / Pm-3m (221) / materials id 27214
Ab-initio phonon calculation for Rb4Br2O / I4/mmm (139) / materials id 30004
Ab-initio phonon calculation for Ga2O3 / C2/m (12) / materials id 886
Ab-initio phonon calculation for Rb3Sm(PS4)2 / P2_1 (4) / materials id 17894
Ab-initio phonon calculation for Na2ZnSiO4 / Pc (7) / materials id 6391
Ab-initio phonon calculation for ZnSeO3 / Pbca (61) / materials id 5338
Ab-initio phonon calculation for BaAgTeF / P4/nmm (129) / materials id 16742
Ab-initio phonon calculation for CaIn2O4 / Fd-3m (227) / materials id 22766
Ab-initio phonon calculation for In(HO)3 / R-3 (148) / materials id 626412
Ab-initio phonon calculation for Cs2TeCl6 / Fm-3m (225) / materials id 23465
Ab-initio phonon calculation for Na2Bi4O7 / C2/c (15) / materials id 780246
Ab-initio phonon calculation for HgPbF6 / R-3 (148) / materials id 35659
Ab-initio phonon calculation for Dy2Ge2O7 / Fd-3m (227) / materials id 754646
Ab-initio phonon calculation for KLaSiSe4 / P2_1 (4) / materials id 861606
Ab-initio phonon calculation for Sr(HO)2 / Pnma (62) / materials id 27425
Ab-initio phonon calculation for KPr3Te8 / P2_1/c (14) / materials id 567710
Ab-initio phonon calculation for Ga3PO7 / R3m (160) / materials id 3107
Ab-initio phonon calculation for AlN / P6_3mc (186) / materials id 661
Ab-initio phonon calculation for Sr2GaSbO6 / Fm-3m (225) / materials id 6065
Ab-initio phonon calculation for SrSO4 / Pnma (62) / materials id 5285
Ab-initio phonon calculation for Y2Be2GeO7 / P-42_1m (113) / materials id 541040
Ab-initio phonon calculation for KTlO / C2/m (12) / materials id 27716
Ab-initio phonon calculation for HPbBrO / Pnma (62) / materials id 643727
Ab-initio phonon calculation for Ca7(H6Cl)2 / P-6 (174) / materials id 984055
Ab-initio phonon calculation for K2Ti(Si2O5)3 / P2_1 (4) / materials id 557301
Ab-initio phonon calculation for Al3Pb5F19 / I4cm (108) / materials id 541732
Ab-initio phonon calculation for LaMg(BO2)5 / P2_1/c (14) / materials id 557758
Ab-initio phonon calculation for Sr3SiO5 / P4/ncc (130) / materials id 5487
Ab-initio phonon calculation for Ca2Hf7O16 / R-3 (148) / materials id 27221
Ab-initio phonon calculation for NdZnPO / R-3m (166) / materials id 9518
Ab-initio phonon calculation for NaMg2H3(SO4)2 / C2/m (12) / materials id 541081
Ab-initio phonon calculation for RbCdBr3 / Pnma (62) / materials id 27400
Ab-initio phonon calculation for K2ZnCl4 / Pna2_1 (33) / materials id 618177
Ab-initio phonon calculation for KErTe2 / R-3m (166) / materials id 9263
Ab-initio phonon calculation for Cs2SnF6 / P-3m1 (164) / materials id 7297
Ab-initio phonon calculation for LiPr(SO4)2 / P2_1/c (14) / materials id 559719
Ab-initio phonon calculation for KPrS2 / R-3m (166) / materials id 15782
Ab-initio phonon calculation for Ba2AlInO5 / P6_3/mmc (194) / materials id 556282
Ab-initio phonon calculation for Ba3(BN2)2 / P2_12_12_1 (19) / materials id 30905
Ab-initio phonon calculation for YNbO4 / C2/c (15) / materials id 5387
Ab-initio phonon calculation for Cs3Sb2I9 / P6_3/mmc (194) / materials id 23029
Ab-initio phonon calculation for NdI3 / P6_3/mmc (194) / materials id 864617
Ab-initio phonon calculation for BaLi2P2O7 / C2/c (15) / materials id 6175
Ab-initio phonon calculation for Cd2Ge7O16 / P-4b2 (117) / materials id 29213
Ab-initio phonon calculation for MgO / Fm-3m (225) / materials id 1265
Ab-initio phonon calculation for Bi2Se3 / R-3m (166) / materials id 541837
Ab-initio phonon calculation for Li2GeF6 / P321 (150) / materials id 5368
Ab-initio phonon calculation for CuI / P6_3mc (186) / materials id 569346
Ab-initio phonon calculation for Ba2NdNbO6 / Fm-3m (225) / materials id 12637
Ab-initio phonon calculation for TbZn(BO2)5 / P2_1/c (14) / materials id 15520
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10,034
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MDR phonon calculation database
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10,034
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Phonon
10,034
P2_1/c (14)
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Pnma (62)
839
C2/c (15)
599
C2/m (12)
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NIMS
10,034
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10,034
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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