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fengyeruge銀蟲 (著名寫手)
crazy
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[求助]
求大神賜ZrMnNi和Zr9Ni11的CIF文件,不勝感激
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求大神賜ZrMnNi和Zr9Ni11的CIF文件 ZrMnNi: C15拉維斯相立方結(jié)構(gòu),pdf卡片號:65-6506 Zr9Ni11: pdf卡片號:33-0963 Zr(Cr0.6Ni0.4)2: C14拉維斯相六方結(jié)構(gòu) pdf卡片號:80-2188 |

版主 (職業(yè)作家)
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*data for ICSD #643180 Coll Code 643180 Rec Date 2008/07/07 Mod Date 2009/08/01 Chem Name Manganese Nickel Zirconium (1/1/1) Structured Mn Ni Zr Sum Mn1 Ni1 Zr1 ANX NO2 D(calc) 7.67 Title Examination of thr Laves phase interactions in the systems Zr (Fe, Co, Ni)2 - Zr Mn2 Author(s) Pet'kov, V.V. Reference Russian Metallurgy (1972), 1972(5), 113-115 Unit Cell 7.08 7.08 7.08 90.0 90.0 90.0 Vol 354.89 Z 8 Space Group F d -3 m S SG Number 227 Cryst Sys cubic Pearson cF24 Wyckoff d a Red Cell F 5.006 5.006 5.006 60 60 60 88.724 Trans Red 0.500 0.500 0.000 / 0.000 0.500 0.500 / 0.500 0.000 0.500 Comments Unit cell dimensions taken from figure Metals Solute Record: (MnxNi1-x)2Zr, x= 0-0.5, a= 0.688- 0.708 nm, (information taken from figure) Metals composition/sof details M= Mn,Ni Structure type : Cu2Mg X-ray diffraction from single crystal No R value given in the paper. At least one temperature factor missing in the paper. Atom # OX SITE x y z SOF H Mn 1 +0 16 d 0.625 0.625 0.625 0.50 0 Ni 1 +0 16 d 0.625 0.625 0.625 0.50 0 Zr 1 +0 8 a 0 0 0 1 0 *end for ICSD #643180 ----------------------------------------- *data for ICSD #105487 Coll Code 105487 Rec Date 2004/10/01 Chem Name Nickel Zirconium (11/9) Structured Ni11 Zr9 Sum Ni11 Zr9 ANX N9O11 D(calc) 7.55 Title Crystal structure of the intermetallic compound Ni11 Zr9 Author(s) Glimois, J.L.;Becle, C.;Develey, G.;Moreau, J.M. Reference Journal of the Less-Common Metals (1979), 64, 87-90 Unit Cell 9.88(1) 9.88 6.61(1) 90. 90. 90. Vol 645.23 Z 2 Space Group I 4/m SG Number 87 Cryst Sys tetragonal Pearson tI40 Wyckoff i h2 d b a R Value .092 Red Cell I 6.61 7.728 7.728 79.462 64.682 64.682 322.616 Trans Red 0.000 0.000 1.000 / -0.500 -0.500 0.500 / 0.500 -0.500 0.500 Comments The structure has been assigned a PDF number (calculated powder diffraction data): 01-072-2681 The structure has been assigned a PDF number (experimental powder diffraction data): 33-963 X-ray diffraction (powder) At least one temperature factor missing in the paper. Atom # OX SITE x y z SOF H Ni 1 +0 2 b 0 0 0.5 1. 0 Ni 2 +0 4 d 0 0.5 0.25 1. 0 Ni 3 +0 16 i 0.225 0.125 0.22 1. 0 Zr 1 +0 2 a 0 0 0 1. 0 Zr 2 +0 8 h 0.405 0.210 0 1. 0 Zr 3 +0 8 h 0.108 0.305 0 1. 0 *end for ICSD #105487 -------------------------------------------- *data for ICSD #70050 Coll Code 70050 Rec Date 1996/10/14 Mod Date 2008/08/01 Chem Name Zirconium Chromium Nickel (1/1.2/0.8) Structured Zr (Cr0.6 Ni0.4)2 Sum Cr1.2 Ni0.8 Zr1 ANX NO2 D(calc) 7.38 Title Neutron diffraction study of Zr (Cr0.6 Ni0.4)2 D3.3 Author(s) Joubert, J.M.;Latroche, M.;Percheron-Guegan, A.;Bouree-Vigneron, F. Reference Journal of Alloys Compd. (1995), 217, 283-286 Unit Cell 5.0291(4) 5.0291(4) 8.2348(7) 90. 90. 120. Vol 180.37 Z 4 Space Group P 63/m m c SG Number 194 Cryst Sys hexagonal Pearson hP12 Wyckoff h f a R Value .057 Red Cell P 5.029 5.029 8.234 90 90 119.999 180.37 Trans Red 1.000 0.000 0.000 / 0.000 1.000 0.000 / 0.000 0.000 1.000 Comments The structure has been assigned a PDF number (calculated powder diffraction data): 01-080-2188 The structure has been assigned a PDF number (experimental powder diffraction data): 48-1309 Rietveld profile refinement applied Structure type : MgZn2 X-ray diffraction (powder) Atom # OX SITE x y z SOF H Zr 1 +0 4 f 0.3333 0.6667 0.0632(5) 1. 0 Cr 1 +0 2 a 0 0 0 0.6 0 Ni 1 +0 2 a 0 0 0 0.4 0 Cr 2 +0 6 h 0.8307(13) 0.6614(26) 0.25 0.6 0 Ni 2 +0 6 h 0.8307(13) 0.6614(26) 0.25 0.4 0 *end for ICSD #70050 |
版主 (職業(yè)作家)
銀蟲 (著名寫手)
crazy

版主 (職業(yè)作家)
銀蟲 (著名寫手)
crazy

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