Pyrophanite
Mitchell R H, Liferovich R P
The Canadian Mineralogist 42 (2004) 1871-1880
The pyrophanite-ecandrewsite solid-solution: crystal structures
of the Mn1-xZnxSiO3 series (0.1 <= x <= 0.8)
Sample: x = .1, ilmenite structure
_database_code_amcsd 0005996
5.13058 5.13058 14.2465 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .36031 .9 .5
Zn 0 0 .36031 .1 .5
Ti 0 0 .14820 .3
O .3205 .0313 .2437 .4
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Pyrophanite
Mitchell R H, Liferovich R P
The Canadian Mineralogist 42 (2004) 1871-1880
The pyrophanite-ecandrewsite solid-solution: crystal structures
of the Mn1-xZnxSiO3 series (0.1 <= x <= 0.8)
Sample: x = .3, ilmenite structure
_database_code_amcsd 0005997
5.11892 5.11892 14.1741 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .36072 .7 .5
Zn 0 0 .36072 .3 .5
Ti 0 0 .14805 .4
O .3206 .0302 .2435 .5
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Pyrophanite-ecandrewsite
Mitchell R H, Liferovich R P
The Canadian Mineralogist 42 (2004) 1871-1880
The pyrophanite-ecandrewsite solid-solution: crystal structures
of the Mn1-xZnxSiO3 series (0.1 <= x <= 0.8)
Sample: x = .5, ilmenite structure
_database_code_amcsd 0005998
5.10630 5.10630 14.0992 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .36093 .5 .7
Zn 0 0 .36093 .5 .7
Ti 0 0 .14779 .2
O .3204 .0297 .2442 .2
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Pyrophanite
Liferovich R P, Mitchell R H
The Canadian Mineralogist 44 (2006) 1099-1107
The pyrophanite-geikielite solid-solution series: crystal structures of the
Mn1-xMgxTiO3 series (0 < x < 0.7)
Sample: XMg = 0.1
Locality: synthetic
_database_code_amcsd 0006102
5.1303 5.1303 14.2428 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .35970 .9 .55
Mg 0 0 .35970 .1 .55
Ti 0 0 .14752 .42
O1 .31989 .03003 .24268 .46
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Pyrophanite
Liferovich R P, Mitchell R H
The Canadian Mineralogist 44 (2006) 1099-1107
The pyrophanite-geikielite solid-solution series: crystal structures of the
Mn1-xMgxTiO3 series (0 < x < 0.7)
Sample: XMg = 0.2
Locality: synthetic
_database_code_amcsd 0006103
5.1234 5.1234 14.2054 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .35960 .8 .58
Mg 0 0 .35960 .2 .58
Ti 0 0 .14741 .21
O1 .32138 .03023 .24304 .42
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Pyrophanite
Liferovich R P, Mitchell R H
The Canadian Mineralogist 44 (2006) 1099-1107
The pyrophanite-geikielite solid-solution series: crystal structures of the
Mn1-xMgxTiO3 series (0 < x < 0.7)
Sample: XMg = 0.3
Locality: synthetic
_database_code_amcsd 0006104
5.1149 5.1149 14.1614 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .35888 .7 .47
Mg 0 0 .35888 .3 .47
Ti 0 0 .14730 .19
O1 .31926 .02725 .24314 .28
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Pyrophanite
Liferovich R P, Mitchell R H
The Canadian Mineralogist 44 (2006) 1099-1107
The pyrophanite-geikielite solid-solution series: crystal structures of the
Mn1-xMgxTiO3 series (0 < x < 0.7)
Sample: XMg = 0.4
Locality: synthetic
_database_code_amcsd 0006105
5.1084 5.1084 14.1286 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .35852 .6 .44
Mg 0 0 .35852 .4 .44
Ti 0 0 .14694 .37
O1 .31943 .02780 .24401 .34
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Pyrophanite
Liferovich R P, Mitchell R H
The Canadian Mineralogist 44 (2006) 1099-1107
The pyrophanite-geikielite solid-solution series: crystal structures of the
Mn1-xMgxTiO3 series (0 < x < 0.7)
Sample: XMg = 0.5
Locality: synthetic
_database_code_amcsd 0006106
5.1007 5.1007 14.0910 90 90 120 R-3
atom x y z occ Biso
Mn 0 0 .35891 .5 .49
Mg 0 0 .35891 .5 .49
Ti 0 0 .14685 .27
O1 .31817 .02865 .24469 .53
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Pyrophanite
Ko J, Prewitt C T
Physics and Chemistry of Minerals 15 (1988) 355-362
High-pressure phase transition in MnTiO3 from the ilmenite to the
LiNbO3 structure
Note: Represents the high pressure phase of pyrophanite
Note: Sample synthesized at 60 kbar and 1300 C
_database_code_amcsd 0007448
5.205 5.205 13.700 90 90 120 R3c
atom x y z Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Mn 0 0 .27616 .69 .00692 .00692 .00125 .00346 0 0
Ti 0 0 0 .46 .00523 .00523 .00069 .002625 0 0
O .0601 .3427 .0634 .60 .0063 .0061 .00103 .0031 -.0005 -.0004
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Pyrophanite
Liferovich R P, Mitchell R H
Physics and Chemistry of Minerals 32 (2005) 442-449
Rhombohedral ilmenite group nickel titanates with Zn, Mg, and Mn:
synthesis and crystal structures
_database_code_amcsd 0008977
5.1386 5.1386 14.2857 90 90 120 R-3
atom x y z Biso
MnA 0 0 .3602 .25
TiB 0 0 .1478 .30
O1 .3200 .0292 .2426 .16
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Pyrophanite
Liferovich R P, Mitchell R H
Physics and Chemistry of Minerals 32 (2005) 442-449
Rhombohedral ilmenite group nickel titanates with Zn, Mg, and Mn:
synthesis and crystal structures
_database_code_amcsd 0008978
5.0855 5.0855 14.0191 90 90 120 R-3
atom x y z occ Biso
NiA 0 0 .3554 .5 .19
MnA 0 0 .3554 .5 .19
TiB 0 0 .1454 .12
O1 .3169 .0247 .2445 .30
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Pyrophanite
Liferovich R P, Mitchell R H
Physics and Chemistry of Minerals 32 (2005) 442-449
Rhombohedral ilmenite group nickel titanates with Zn, Mg, and Mn:
synthesis and crystal structures
_database_code_amcsd 0008979
5.0770 5.0770 13.9727 90 90 120 R-3
atom x y z occ Biso
NiA 0 0 .3578 .25 .56
MnA 0 0 .3578 .25 .56
ZnA 0 0 .3578 .25 .56
MgA 0 0 .3578 .25 .56
TiB 0 0 .1459 .22
O1 .3202 .0240 .2462 .60
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Pyrophanite
Kidoh K, Tanaka K, Marumo F, Takei H
Acta Crystallographica B40 (1984) 329-332
Electron density distribution in ilmenite-type crystals. II.
Manganese (II) titanium (IV) trioxide
Sample: ilmenite structure
_database_code_amcsd 0009805
5.139 5.139 14.283 90 90 120 R-3
atom x y z
Mn 0 0 .36002
Ti 0 0 .14758
O .3189 .0310 .24393
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