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American Mineralogist Crystal Structure Database

2 matching records for this search.

Tomichite
Download hom/tomichite.pdf 
Grey I E, Madsen I C, Harris D C
Download am/vol72/AM72_201.pdf 
American Mineralogist 72 (1987) 201-208
Barian tomichite, Ba.5(As2).5Ti2(V,Fe)5O13(OH), its crystal structure and
relationship to derbylite and tomichite
_database_code_amcsd 0001066
7.105 14.217 5.043 90 104.97 90 A2/m
atom     x     y     z  occ U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Ti1      0     0     0  .55  .0086  .0078  .0087      0  .0016      0
V1       0     0     0 .225  .0086  .0078  .0087      0  .0016      0
Fe1      0     0     0 .225  .0086  .0078  .0087      0  .0016      0
Ti2      0 .6172     0  .45  .0079  .0141  .0102      0  .0034      0
V2       0 .6172     0 .275  .0079  .0141  .0102      0  .0034      0
Fe2      0 .6172     0 .275  .0079  .0141  .0102      0  .0034      0
Ti3  .3171 .1916 .1185  .24  .0060  .0074  .0062 -.0018  .0025 -.0007
V3   .3171 .1916 .1185  .38  .0060  .0074  .0062 -.0018  .0025 -.0007
Fe3  .3171 .1916 .1185  .38  .0060  .0074  .0062 -.0018  .0025 -.0007
Ba      .5    .5     0  .35  .0102  .0084  .0095      0 -.0028      0
As   .5807     0 .2396  .47  .0032  .0047  .0099      0  .0013      0
O1   .1593 .0983 .2329        .008   .008   .009  -.001   .003   .000
O2   .1741 .2985 .2275        .008   .010   .006   .003   .000   .001
O3      .5 .2859     0        .006   .008   .006      0   .002      0
O4      .5 .0947     0        .015   .008   .016      0   .002      0
O5   .1488     0 .7175        .011   .009   .010      0   .004      0


  Download AMC data (View Text File)
  Download CIF data (View Text File)
  Download diffraction data (View Text File)
  View JMOL 3-D Structure (permalink)

	 




	

Tomichite





	Download hom/tomichite.pdf
	
Grey I E, Madsen I C, Harris D C




	Download am/vol72/AM72_201.pdf
	
American Mineralogist 72 (1987) 201-208




	
	
Barian tomichite, Ba.5(As2).5Ti2(V,Fe)5O13(OH), its crystal structure and




	
	
relationship to derbylite and tomichite




	
	
_database_code_amcsd 0001067




	
	
7.119 14.176 4.992 90 105.1 90 P2_1/m




	
	
atom     x      y     z  occ Biso




	
	
Ti1  .4965    .25 .7453   .6  .35




	
	
V1   .4965    .25 .7453   .3  .35




	
	
Fe1  .4965    .25 .7453   .1  .35




	
	
Ti2  .5017  .1289 .2484  .62  .23




	
	
V2   .5017  .1289 .2484 .285  .23




	
	
Fe2  .5017  .1289 .2484 .095  .23




	
	
Ti3  .8171  .0606 .8736   .3  .10




	
	
V3   .8171  .0606 .8736 .525  .10




	
	
Fe3  .8171  .0606 .8736 .175  .10




	
	
Ti4  .8195 -.0620 .3755  .27  .15




	
	
V4   .8195 -.0620 .3755  .55  .15




	
	
Fe4  .8195 -.0620 .3755  .18  .15




	
	
As   .0789    .25 .0125       .47




	
	
O1    .342    .25  .033       .01




	
	
O2    .673  -.047 -.023       .50




	
	
O3    .654   .152 -.023       .19




	
	
O4    .003   .155  .756       .52




	
	
O5    .002   .034  .252       .45




	
	
O6    .677   .048  .483       .34




	
	
O7    .342   .152  .516       .43




	
	
O8    .647    .25  .458       .38




	
	


  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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	Total number of retrieved datasets: 2

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