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[求助]
僅僅有XRD數(shù)據(jù),怎么構(gòu)建模型?
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各位老師,我現(xiàn)在合成了TT-Nb2O5,其XRD數(shù)據(jù)如下: DF#28-0317: QM=Uncommon(?); d=Diffractometer; I=(Unknown) Niobium Oxide Nb2O5 Radiation=CuKa1 Lambda=1.5406 Filter= Calibration= 2T=22.606-58.969 I/Ic(RIR)= Ref: Level-1 PDF Hexagonal(Primitive) Z=1 mp= CELL: 3.607 x 3.607 x 3.925 <90.0 x 90.0 x 120.0> P.S= Density(c)=9.981 Density(m)= Mwt= Vol=44.2 Ref: Ibid. Strong Lines: 3.12/X 3.93/9 2.45/4 1.66/3 1.96/3 1.80/3 1.64/1 1.57/1 2-Theta d(?) I(f) ( h k l) Theta 1/(2d) 2pi/d n^2 22.606 3.9300 90.0 ( 0 0 1) 11.303 0.1272 1.5988 28.586 3.1200 100.0 ( 1 0 0) 14.293 0.1603 2.0138 36.711 2.4460 40.0 ( 1 0 1) 18.356 0.2044 2.5688 46.233 1.9620 30.0 ( 0 0 2) 23.116 0.2548 3.2024 50.673 1.8000 25.0 ( 1 1 0) 25.336 0.2778 3.4907 55.186 1.6630 30.0 ( 1 0 2) 27.593 0.3007 3.7782 56.139 1.6370 14.0 ( 1 1 1) 28.070 0.3054 3.8382 58.969 1.5650 12.0 ( 2 0 0) 29.485 0.3195 4.0148 求助,如何在MS中構(gòu)建模型呢? |
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