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Phosphorus |
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Wyckoff R W G |
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Crystal Structures 1 (1963) 7-83 |
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Second edition. Interscience Publishers, New York, New York |
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Sample known as black phosphorus |
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_database_code_amcsd 0011250 |
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3.31 4.38 10.50 90 90 90 Bmab |
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atom x y z |
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P 0 .090 .098 |
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| Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013008 |
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3.3133 10.473 4.374 90 90 90 Cmca |
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atom x y z |
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P 0 .1034 .0806 |
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| Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = .41 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013009 |
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3.3121 10.408 4.350 90 90 90 Cmca |
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atom x y z |
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P 0 .1032 .0798 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = .71 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013010 |
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3.3105 10.363 4.335 90 90 90 Cmca |
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atom x y z |
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P 0 .1045 .0793 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 1.02 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013011 |
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3.3109 10.319 4.317 90 90 90 Cmca |
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atom x y z |
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P 0 .1045 .0794 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 1.27 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013012 |
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3.3109 10.209 4.302 90 90 90 Cmca |
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atom x y z |
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P 0 .1052 .0779 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 1.51 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013013 |
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3.3116 10.260 4.289 90 90 90 Cmca |
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atom x y z |
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P 0 .1050 .0782 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 1.73 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013014 |
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3.3114 10.233 4.278 90 90 90 Cmca |
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atom x y z |
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P 0 .1053 .0772 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 1.93 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013015 |
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3.3111 10.215 4.266 90 90 90 Cmca |
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atom x y z |
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P 0 .1054 .0771 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 2.16 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013016 |
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3.3114 10.189 4.254 90 90 90 Cmca |
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atom x y z |
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P 0 .1053 .0769 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
| |
|
Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
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Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 2.43 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013017 |
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3.3117 10.158 4.243 90 90 90 Cmca |
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atom x y z |
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P 0 .1054 .0747 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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|
Phosphorus |
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Cartz L, Srinivasa S R, Riedner R J, Jorgensen J D, Worlton T G |
| |
Journal of Chemical Physics 71 (1979) 1718-1721 |
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Effect of pressure on bonding in black phosphorus |
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Locality: synthetic |
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Sample: at P = 2.66 GPa |
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Note: pressures calculated from the measured unit cell volume |
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_database_code_amcsd 0013018 |
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3.3120 10.140 4.229 90 90 90 Cmca |
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atom x y z |
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P 0 .1053 .0749 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Simon A, Borrmann H, Craubner H |
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Phosphorus and Sulfur and the Related Elements 30 (1987) 507-510 |
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Crystal structure of ordered white phosphorus (beta-P) |
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Locality: synthetic |
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Sample: at T = 158.15 K |
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Note: beta phase; transforms from alpha phase at T = 196.75 K |
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_database_code_amcsd 0014997 |
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11.450 5.503 11.261 71.84 90.37 71.56 P-1 |
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atom x y z Uiso U(1,1) U(2,2) U(3,3) U(2,3) U(1,3) U(1,2) |
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P1 .67802 .39370 .00247 .0515 .0360 .0496 .0587 -.0196 -.0048 .0005 |
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P2 .52922 .88513 .17722 .0520 .0639 .0528 .0305 .0003 -.0045 -.0218 |
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P3 .18938 .92202 .05123 .0513 .0660 .0445 .0485 -.0294 -.0047 -.0115 |
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P4 .55505 .84909 .37360 .0501 .0640 .0472 .0462 -.0289 -.0002 -.0151 |
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P5 .02641 .34671 .31490 .0496 .0392 .0627 .0501 -.0222 -.0093 -.0180 |
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P6 .87186 .35722 .01126 .0506 .0510 .0486 .0628 -.0191 .0051 -.0303 |
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P7 .67157 .53535 .30808 .0560 .0409 .0472 .0709 -.0251 .0006 .0026 |
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P8 .47750 .58127 .31956 .0516 .0534 .0467 .0567 -.0076 -.0017 -.0291 |
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P9 .13526 .55621 .37416 .0480 .0598 .0353 .0576 -.0216 .0057 -.0216 |
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P10 .81346 .05347 .14518 .0526 .0644 .0481 .0323 -.0001 -.0008 -.0148 |
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P11 .14244 .15713 .49419 .0480 .0595 .0465 .0305 -.0040 -.0004 -.0163 |
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P12 .22608 .20514 .31893 .0505 .0439 .0523 .0515 -.0239 .0135 -.0041 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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Phosphorus |
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Crichton W A, Mezouar M, Monaco G, Falconi S |
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Powder Diffraction 18 (2003) 155-158 |
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Phosphorus: new in situ powder data from large-volume apparatus |
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Locality: synthetic |
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Sample: at P = 1.2 GPa and T = 1100 K |
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_database_code_amcsd 0015324 |
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3.3199 10.3678 4.3154 90 90 90 Cmca |
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atom x y z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3) |
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P .5 .10437 .9179 .0481 .0401 .0773 0 0 -.059 |
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| Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink) |
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