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Ab-initio phonon calculation for CsAuF4 / Immm (71) / materials id 572767
Ab-initio phonon calculation for HoIO / P4/nmm (129) / materials id 753173
Ab-initio phonon calculation for Be4TeO7 / F-43m (216) / materials id 27608
Ab-initio phonon calculation for GaCuI4 / I-4 (82) / materials id 29403
Ab-initio phonon calculation for Cs2HgI4 / P2_1 (4) / materials id 567594
Ab-initio phonon calculation for SbO2 / Pnna (52) / materials id 560098
Ab-initio phonon calculation for CdI2 / P3m1 (156) / materials id 570410
Ab-initio phonon calculation for AlHg2SbCl4 / Pbcn (60) / materials id 568001
Ab-initio phonon calculation for Cd4GeSe6 / Cc (9) / materials id 18163
Ab-initio phonon calculation for XeF3 / P2_1/c (14) / materials id 561153
Ab-initio phonon calculation for Yb11GaSb9 / Iba2 (45) / materials id 569811
Ab-initio phonon calculation for Li2ZnCl4 / Fd-3m (227) / materials id 22961
Ab-initio phonon calculation for Dy(HO)3 / P6_3/m (176) / materials id 24074
Ab-initio phonon calculation for Ba3Lu2Zn5O11 / F-43m (216) / materials id 554066
Ab-initio phonon calculation for KY2CuS4 / Cmcm (63) / materials id 11602
Ab-initio phonon calculation for KAuO2 / Pmmm (47) / materials id 27418
Ab-initio phonon calculation for CsBi3Se5 / Pnma (62) / materials id 567928
Ab-initio phonon calculation for Ba2CuIO2 / P2_1/m (11) / materials id 561179
Ab-initio phonon calculation for SrPSe3 / P2_1/c (14) / materials id 7198
Ab-initio phonon calculation for Li4Ti7O16 / Pnnm (58) / materials id 531820
Ab-initio phonon calculation for K2Ti8O17 / C2/m (12) / materials id 762279
Ab-initio phonon calculation for Na5P3O10 / C2/c (15) / materials id 557529
Ab-initio phonon calculation for In2GaBiS6 / P2_1/m (11) / materials id 556231
Ab-initio phonon calculation for MgTi2(PO5)2 / P2_1/c (14) / materials id 561065
Ab-initio phonon calculation for SrSi2(BO4)2 / Pnma (62) / materials id 6032
Ab-initio phonon calculation for TlCl / Fm-3m (225) / materials id 569639
Ab-initio phonon calculation for Rb3AlO3 / C2/m (12) / materials id 14951
Ab-initio phonon calculation for H8Pt(NCl3)2 / Fm-3m (225) / materials id 24227
Ab-initio phonon calculation for K6Na3AlSb4 / P6_3/mmc (194) / materials id 541707
Ab-initio phonon calculation for Ta2Pt3S8 / Pbam (55) / materials id 560046
Ab-initio phonon calculation for Na2LiNF6 / Fm-3m (225) / materials id 989504
Ab-initio phonon calculation for Tl2Sn2S5 / C2/c (15) / materials id 7499
Ab-initio phonon calculation for La(BO2)3 / P2_1/c (14) / materials id 561154
Ab-initio phonon calculation for Tl3PbBr5 / P2_12_12_1 (19) / materials id 27451
Ab-initio phonon calculation for Mg14Ge5O24 / Pbam (55) / materials id 27295
Ab-initio phonon calculation for Y(AlCl4)3 / P3_112 (151) / materials id 570857
Ab-initio phonon calculation for Ba4Nd2Cd3Se10 / Cmc2_1 (36) / materials id 10409
Ab-initio phonon calculation for Ta9PO25 / I-4 (82) / materials id 770481
Ab-initio phonon calculation for Na3BiBAsO7 / P2_1/m (11) / materials id 770475
Ab-initio phonon calculation for TbOF / R-3m (166) / materials id 14093
Ab-initio phonon calculation for K2CuSbS3 / P2_1/c (14) / materials id 554343
Ab-initio phonon calculation for NaLi2BO3 / P2_1/c (14) / materials id 560189
Ab-initio phonon calculation for Mg(ReO4)2 / P31m (157) / materials id 768770
Ab-initio phonon calculation for MgSn(BO3)2 / R-3 (148) / materials id 11715
Ab-initio phonon calculation for NdSeF / P4/nmm (129) / materials id 12620
Ab-initio phonon calculation for K2CuSb / Cmcm (63) / materials id 10381
Ab-initio phonon calculation for Sr4TiP4 / P-43n (218) / materials id 15500
Ab-initio phonon calculation for Rb2NaHoF6 / Fm-3m (225) / materials id 15317
Ab-initio phonon calculation for NaGe2N3 / Cmc2_1 (36) / materials id 14433
Ab-initio phonon calculation for Rb3P6N11 / P4_132 (213) / materials id 16107
Ab-initio phonon calculation for SrAgB7O12 / C2/c (15) / materials id 554259
Ab-initio phonon calculation for Sm2O3 / Ia-3 (206) / materials id 218
Ab-initio phonon calculation for BaB4O7 / Pnma (62) / materials id 556974
Ab-initio phonon calculation for YOF / P4/nmm (129) / materials id 10219
Ab-initio phonon calculation for Ba(SbS2)2 / P2_1/c (14) / materials id 28129
Ab-initio phonon calculation for Mg(AlSe2)2 / R-3m (166) / materials id 9479
Ab-initio phonon calculation for MgUB2O7 / Pbcm (57) / materials id 557384
Ab-initio phonon calculation for NdAg(PO3)4 / P2_1/c (14) / materials id 541041
Ab-initio phonon calculation for Na3Mg2P5O16 / P2/c (13) / materials id 555005
Ab-initio phonon calculation for LiBiF4 / I4_1/a (88) / materials id 28567
Ab-initio phonon calculation for K2Mg2O3 / P2_1/c (14) / materials id 753662
Ab-initio phonon calculation for RbClO4 / F-43m (216) / materials id 550759
Ab-initio phonon calculation for Sm3Si6N11 / P4bm (100) / materials id 16995
Ab-initio phonon calculation for Nd2Si2O7 / P2_12_12_1 (19) / materials id 556771
Ab-initio phonon calculation for Cs2U(Br2O)2 / P2_1/c (14) / materials id 572551
Ab-initio phonon calculation for Ba4Sn3O10 / Cmce (64) / materials id 772086
Ab-initio phonon calculation for Ca5P8 / C2/m (12) / materials id 28879
Ab-initio phonon calculation for Cs2RbTlF6 / Fm-3m (225) / materials id 989567
Ab-initio phonon calculation for Nd4Te3N2 / Pnma (62) / materials id 570646
Ab-initio phonon calculation for Na2Sr(PO3)4 / P4/nbm (125) / materials id 540951
Ab-initio phonon calculation for In2Si2O7 / C2/m (12) / materials id 2874
Ab-initio phonon calculation for KCrP2S7 / C2 (5) / materials id 7147
Ab-initio phonon calculation for YAg3(PS4)2 / C2/c (15) / materials id 561467
Ab-initio phonon calculation for Sm(HO)3 / P2_1/m (11) / materials id 625409
Ab-initio phonon calculation for Na4HgP2 / R-3m (166) / materials id 28591
Ab-initio phonon calculation for Rb6Si10O23 / P-62m (189) / materials id 561189
Ab-initio phonon calculation for AsH6NO4 / I-42d (122) / materials id 703470
Ab-initio phonon calculation for K2Pb(SO4)2 / R-3m (166) / materials id 21099
Ab-initio phonon calculation for K3Nb3(BO6)2 / Pmc2_1 (26) / materials id 557711
Ab-initio phonon calculation for KRb2BiF6 / Fm-3m (225) / materials id 554941
Ab-initio phonon calculation for Mg3B7ClO13 / Pca2_1 (29) / materials id 23087
Ab-initio phonon calculation for Sr5U3O14 / Pbca (61) / materials id 29743
Ab-initio phonon calculation for Cd2AsCl2 / P2_1/c (14) / materials id 27776
Ab-initio phonon calculation for LaBrO / P4/nmm (129) / materials id 23023
Ab-initio phonon calculation for CuAg3S2 / I4_1/a (88) / materials id 644883
Ab-initio phonon calculation for CsEr(NbBr3)6 / P-31c (163) / materials id 569903
Ab-initio phonon calculation for Sr2LiIn(B2O5)2 / P2_1/c (14) / materials id 14854
Ab-initio phonon calculation for Cs2Te13 / Pbcm (57) / materials id 505464
Ab-initio phonon calculation for Sr4GeP4 / P-43n (218) / materials id 14213
Ab-initio phonon calculation for Tl4SnS4 / P2_1/c (14) / materials id 5818
Ab-initio phonon calculation for RbCaCO3F / P-62m (189) / materials id 867757
Ab-initio phonon calculation for Sb5IO7 / P-62c (190) / materials id 28485
Ab-initio phonon calculation for Ba5Si(Br3O2)2 / C2/c (15) / materials id 553884
Ab-initio phonon calculation for Cs3BAs2 / C2/c (15) / materials id 573658
Ab-initio phonon calculation for Ag5BiO4 / P2_1/c (14) / materials id 28812
Ab-initio phonon calculation for Te3As2 / R-3m (166) / materials id 9897
Ab-initio phonon calculation for Ag2GeS3 / Cmc2_1 (36) / materials id 9900
Ab-initio phonon calculation for TeO3 / R-3c (167) / materials id 2552
Ab-initio phonon calculation for Dy2Ge2O7 / Pnma (62) / materials id 773011
Ab-initio phonon calculation for Ar / Fm-3m (225) / materials id 23155
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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
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Phonon
10,137
P2_1/c (14)
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Pnma (62)
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C2/c (15)
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10,137
Rights Statement Sim
Creative Commons BY Attribution 4.0 International
10,137
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simulation
10,034
simulations
103
Author
Atsushi Togo
10,137
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MEXT
10,034
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VASP
10,137
phonopy
10,137
spglib
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10,137
phono3py
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