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Ab-initio phonon calculation for Sr2LiIn(B2O5)2 / P2_1/c (14) / materials id 14854
Ab-initio phonon calculation for CsEr(NbBr3)6 / P-31c (163) / materials id 569903
Ab-initio phonon calculation for CuAg3S2 / I4_1/a (88) / materials id 644883
Ab-initio phonon calculation for LaBrO / P4/nmm (129) / materials id 23023
Ab-initio phonon calculation for Cd2AsCl2 / P2_1/c (14) / materials id 27776
Ab-initio phonon calculation for Sr5U3O14 / Pbca (61) / materials id 29743
Ab-initio phonon calculation for Mg3B7ClO13 / Pca2_1 (29) / materials id 23087
Ab-initio phonon calculation for KRb2BiF6 / Fm-3m (225) / materials id 554941
Ab-initio phonon calculation for K3Nb3(BO6)2 / Pmc2_1 (26) / materials id 557711
Ab-initio phonon calculation for K2Pb(SO4)2 / R-3m (166) / materials id 21099
Ab-initio phonon calculation for AsH6NO4 / I-42d (122) / materials id 703470
Ab-initio phonon calculation for Rb6Si10O23 / P-62m (189) / materials id 561189
Ab-initio phonon calculation for Na4HgP2 / R-3m (166) / materials id 28591
Ab-initio phonon calculation for Sm(HO)3 / P2_1/m (11) / materials id 625409
Ab-initio phonon calculation for YAg3(PS4)2 / C2/c (15) / materials id 561467
Ab-initio phonon calculation for KCrP2S7 / C2 (5) / materials id 7147
Ab-initio phonon calculation for In2Si2O7 / C2/m (12) / materials id 2874
Ab-initio phonon calculation for Na2Sr(PO3)4 / P4/nbm (125) / materials id 540951
Ab-initio phonon calculation for Nd4Te3N2 / Pnma (62) / materials id 570646
Ab-initio phonon calculation for Cs2RbTlF6 / Fm-3m (225) / materials id 989567
Ab-initio phonon calculation for Ca5P8 / C2/m (12) / materials id 28879
Ab-initio phonon calculation for Ba4Sn3O10 / Cmce (64) / materials id 772086
Ab-initio phonon calculation for Cs2U(Br2O)2 / P2_1/c (14) / materials id 572551
Ab-initio phonon calculation for Nd2Si2O7 / P2_12_12_1 (19) / materials id 556771
Ab-initio phonon calculation for Sm3Si6N11 / P4bm (100) / materials id 16995
Ab-initio phonon calculation for RbClO4 / F-43m (216) / materials id 550759
Ab-initio phonon calculation for K2Mg2O3 / P2_1/c (14) / materials id 753662
Ab-initio phonon calculation for LiBiF4 / I4_1/a (88) / materials id 28567
Ab-initio phonon calculation for Na3Mg2P5O16 / P2/c (13) / materials id 555005
Ab-initio phonon calculation for NdAg(PO3)4 / P2_1/c (14) / materials id 541041
Ab-initio phonon calculation for MgUB2O7 / Pbcm (57) / materials id 557384
Ab-initio phonon calculation for Mg(AlSe2)2 / R-3m (166) / materials id 9479
Ab-initio phonon calculation for Ba(SbS2)2 / P2_1/c (14) / materials id 28129
Ab-initio phonon calculation for YOF / P4/nmm (129) / materials id 10219
Ab-initio phonon calculation for BaB4O7 / Pnma (62) / materials id 556974
Ab-initio phonon calculation for Sm2O3 / Ia-3 (206) / materials id 218
Ab-initio phonon calculation for SrAgB7O12 / C2/c (15) / materials id 554259
Ab-initio phonon calculation for Rb3P6N11 / P4_132 (213) / materials id 16107
Ab-initio phonon calculation for NaGe2N3 / Cmc2_1 (36) / materials id 14433
Ab-initio phonon calculation for Rb2NaHoF6 / Fm-3m (225) / materials id 15317
Ab-initio phonon calculation for Sr4TiP4 / P-43n (218) / materials id 15500
Ab-initio phonon calculation for K2CuSb / Cmcm (63) / materials id 10381
Ab-initio phonon calculation for NdSeF / P4/nmm (129) / materials id 12620
Ab-initio phonon calculation for MgSn(BO3)2 / R-3 (148) / materials id 11715
Ab-initio phonon calculation for Mg(ReO4)2 / P31m (157) / materials id 768770
Ab-initio phonon calculation for NaLi2BO3 / P2_1/c (14) / materials id 560189
Ab-initio phonon calculation for K2CuSbS3 / P2_1/c (14) / materials id 554343
Ab-initio phonon calculation for TbOF / R-3m (166) / materials id 14093
Ab-initio phonon calculation for Na3BiBAsO7 / P2_1/m (11) / materials id 770475
Ab-initio phonon calculation for Ta9PO25 / I-4 (82) / materials id 770481
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10,137
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MDR phonon calculation database
10,034
Lattice thermal conductivity calculation datasets for 103 binary compounds by finite displacement method
103
Keyword
Phonon
10,137
P2_1/c (14)
1,072
Pnma (62)
839
C2/c (15)
599
C2/m (12)
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NIMS
10,137
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10,137
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Creative Commons BY Attribution 4.0 International
10,137
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simulation
10,034
simulations
103
Author
Atsushi Togo
10,137
Funder
MEXT
10,034
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VASP
10,137
phonopy
10,137
spglib
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10,137
phono3py
103