Al3Ti

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Date: 12/12/2013 Time: 9:36:45 PM User: SATVK-AMLAN File: AA2024-T64 FSW Exp3_ Broken interface sample 1 Of 3 Name and formula Reference code: 98-008-4740 Compound name: Aluminium Titanium (3/1) Chemical name: Aluminium Titanium (3/1) Common name: Aluminium Titanium (3/1) ICSD name: Aluminium Titanium (3/1) Chemical formula: Al 3 Ti 1 Second chemical formula: Al 3 Ti Crystallographic parameters Crystal system: Tetragonal Space group: I 4/m m m Space group number: 139 a (Å): 3.8510 b (Å): 3.8510 c (Å): 8.6100 Alpha (°): 90.0000 Beta (°): 90.0000 Gamma (°): 90.0000 Calculated density (g/cm^3): 3.35 Volume of cell (10^6 pm^3): 127.69 Z: 2.00 RIR: 4.90 Subfiles and Quality Subfiles: ICSD Pattern Inorganic Quality: Calculated (C) Comments ICSD collection code: 609547 Creation Date: 1/1/1970 Modification Date: 1/1/1970 Calculated Pattern Original Remarks: Metals Sdata Record: Structures: Al3Ti Original ICSD space group: I4/MMM ICSD Collection Code: 609547 Original ICSD space group: I4/MMM At least one temperature factor missing in the paper. No R value given in the paper X-ray diffraction from single crystal \N Structure type: Al3Ti Metals Sdata Record: APP= diffractometer Structure type: Al3Ti Recording date: 8/1/2008

Transcript of Al3Ti

Page 1: Al3Ti

Date: 12/12/2013 Time: 9:36:45 PM User: SATVK-AMLANFile: AA2024-T64 FSW Exp3_ Broken interface sample

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Name and formula

Reference code: 98-008-4740

Compound name: Aluminium Titanium (3/1)Chemical name: Aluminium Titanium (3/1)Common name: Aluminium Titanium (3/1)ICSD name: Aluminium Titanium (3/1)

Chemical formula: Al3Ti1Second chemical formula: Al3Ti

Crystallographic parameters

Crystal system: TetragonalSpace group: I 4/m m mSpace group number: 139

a (Å): 3.8510b (Å): 3.8510c (Å): 8.6100Alpha (°): 90.0000Beta (°): 90.0000Gamma (°): 90.0000

Calculated density (g/cm^3): 3.35Volume of cell (10^6 pm^3): 127.69Z: 2.00

RIR: 4.90

Subfiles and Quality

Subfiles: ICSD PatternInorganic

Quality: Calculated (C)

Comments

ICSD collection code: 609547Creation Date: 1/1/1970Modification Date: 1/1/1970Calculated Pattern Original Remarks: Metals Sdata Record:Structures: Al3TiOriginal ICSD space group: I4/MMMICSD Collection Code: 609547

Original ICSD space group: I4/MMMAt least one temperature factor missing in the paper.No R value given in the paper

X-ray diffraction from single crystal \NStructure type: Al3Ti

Metals Sdata Record: APP= diffractometerStructure type: Al3TiRecording date: 8/1/2008

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ANX formula: NO3Z: 2Calculated density: 3.35Pearson code: tI8Wyckoff code: d b aPubl. title: The texture in diffusion-grown layers of trialuminidesMe Al3 (Me= Ti, V, Ta, Nb, Zr, Hf) and V Ni3

References

Primary reference: Metselaar, R. van Loo, F.J.J. Bastin, G.F. Maas, J., Zeitschrift fuer Metallkunde, 74, 294,(1983)

Peak list

No. h k l d [A] 2Theta[deg] I [%] 1 0 0 2 4.30500 20.615 3.6 2 0 1 1 3.51539 25.315 8.4 3 1 1 0 2.72307 32.864 2.1 4 1 1 2 2.30133 39.111 100.0 5 0 0 4 2.15250 41.938 19.7 6 0 2 0 1.92550 47.163 27.8 7 0 2 2 1.75770 51.984 0.9 8 1 1 4 1.68864 54.280 2.4 9 0 1 5 1.57200 58.683 0.6 10 1 2 3 1.47674 62.882 0.9 11 0 2 4 1.43510 64.926 19.8 12 0 0 6 1.43500 64.931 20.0 13 2 2 0 1.36153 68.910 7.8 14 2 2 2 1.29816 72.794 0.3 15 0 3 1 1.26963 74.704 12.2 16 1 1 6 1.26951 74.713 12.7 17 1 3 0 1.21779 78.475 0.6 18 1 2 5 1.21772 78.481 0.6 19 0 3 3 1.17180 82.199 18.0 20 0 1 7 1.17169 82.208 18.3 21 2 2 4 1.15066 84.048 8.6

Structure

No. Name Elem. X Y Z Biso sof Wyck.1 TI1 Ti 0.00000 0.00000 0.00000 0.5000 1.0000 2a2 AL1 Al 0.00000 0.50000 0.25000 0.5000 1.0000 4d3 AL2 Al 0.00000 0.00000 0.50000 0.5000 1.0000 2b

Stick Pattern

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