American Mineralogist Crystal Structure Database

85 matching records for this search.

Beryl
Download hom/beryl.pdf
Brown G E, Mills B A
Download am/vol71/AM71_547.pdf
American Mineralogist 71 (1986) 547-556
High-temperature structure and crystal chemistry of hydrous alkali-rich beryl
from the Harding pegmatite, Taos County, New Mexico
Sample: T = 24 deg C, before heating
O2x has been corrected
_database_code_amcsd 0001011
9.236 9.236 9.246 90 90 120 P6/mcc
atom      x     y     z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Be2      .5     0   .25 .86  .0033  .0025  .0031 .00125      0      0
Li2      .5     0   .25 .13  .0033  .0025  .0031 .00125      0      0
Al2      .5     0   .25 .01  .0033  .0025  .0031 .00125      0      0
Al      2/3   1/3   .25      .0015  .0015  .0012 .00075      0      0
Si1   .3893 .1189     0 .98  .0011  .0014  .0013  .0007      0      0
Al1   .3893 .1189     0 .02  .0011  .0014  .0013  .0007      0      0
O1    .3057  .235     0      .0039  .0031  .0047  .0027      0      0
O2    .4985 .1468 .1445      .0034  .0041  .0025  .0024 -.0018 -.0012
WatC1     0     0   .25 .55  .0068  .0068  .0043  .0034      0      0
CsC1      0     0   .25 .09  .0068  .0068  .0043  .0034      0      0
KC1       0     0   .25 .05  .0068  .0068  .0043  .0034      0      0
NaC2      0     0     0 .21  .0005  .0005  .0096 .00025      0      0
CaC2      0     0     0 .02  .0005  .0005  .0096 .00025      0      0
MgC2      0     0     0 .02  .0005  .0005  .0096 .00025      0      0
FeC2      0     0     0 .01  .0005  .0005  .0096 .00025      0      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Brown G E, Mills B A
Download am/vol71/AM71_547.pdf
American Mineralogist 71 (1986) 547-556
High-temperature structure and crystal chemistry of hydrous alkali-rich beryl
from the Harding pegmatite, Taos County, New Mexico
Sample: T = 500 deg C
_database_code_amcsd 0001012
9.251 9.251 9.260 90 90 120 P6/mcc
atom      x     y     z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Be2      .5     0   .25 .86  .0018  .0198  .0035  .0099      0      0
Li2      .5     0   .25 .13  .0018  .0198  .0035  .0099      0      0
Al2      .5     0   .25 .01  .0018  .0198  .0035  .0099      0      0
Al      2/3   1/3   .25      .0041  .0041  .0031 .00205      0      0
Si1   .3892 .1194     0 .98  .0019  .0025  .0025  .0012      0      0
Al1   .3892 .1194     0 .02  .0019  .0025  .0025  .0012      0      0
O1    .3039 .2340     0      .0068  .0039  .0102  .0045      0      0
O2    .4966 .1456 .1436      .0056  .0068  .0043  .0048 -.0015 -.0004
WatC1     0     0   .25 .55  .0133  .0133  .0080 .00665      0      0
CsC1      0     0   .25 .09  .0133  .0133  .0080 .00665      0      0
KC1       0     0   .25 .05  .0133  .0133  .0080 .00665      0      0
NaC2      0     0     0 .21  .0083  .0083  .0034 .00415      0      0
CaC2      0     0     0 .02  .0083  .0083  .0034 .00415      0      0
MgC2      0     0     0 .02  .0083  .0083  .0034 .00415      0      0
FeC2      0     0     0 .01  .0083  .0083  .0034 .00415      0      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Brown G E, Mills B A
Download am/vol71/AM71_547.pdf
American Mineralogist 71 (1986) 547-556
High-temperature structure and crystal chemistry of hydrous alkali-rich beryl
from the Harding pegmatite, Taos County, New Mexico
Sample: T = 800 deg C
_database_code_amcsd 0001013
9.259 9.259 9.264 90 90 120 P6/mcc
atom      x     y     z occ B(1,1) B(2,2) B(3,3)  B(1,2) B(1,3) B(2,3)
Be2      .5     0   .25 .86  .0064  .0025  .0062 -.00125      0      0
Li2      .5     0   .25 .13  .0064  .0025  .0062 -.00125      0      0
Al2      .5     0   .25 .01  .0064  .0025  .0062 -.00125      0      0
Al      2/3   1/3   .25      .0046  .0046  .0027   .0023      0      0
Si1   .3886 .1183     0 .98  .0032  .0038  .0027   .0018      0      0
Al1   .3886 .1183     0 .02  .0032  .0038  .0027   .0018      0      0
O1    .3042 .2336     0      .0079  .0041  .0090   .0042      0      0
O2    .4974 .1465 .1438      .0083  .0056  .0048   .0036 -.0039 -.0013
WatC1     0     0   .25 .55  .0272  .0272  .0106   .0136      0      0
CsC1      0     0   .25 .09  .0272  .0272  .0106   .0136      0      0
KC1       0     0   .25 .05  .0272  .0272  .0106   .0136      0      0
NaC2      0     0     0 .21  .0002  .0002  .0293   .0001      0      0
CaC2      0     0     0 .02  .0002  .0002  .0293   .0001      0      0
MgC2      0     0     0 .02  .0002  .0002  .0293   .0001      0      0
FeC2      0     0     0 .01  .0002  .0002  .0293   .0001      0      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Brown G E, Mills B A
Download am/vol71/AM71_547.pdf
American Mineralogist 71 (1986) 547-556
High-temperature structure and crystal chemistry of hydrous alkali-rich beryl
from the Harding pegmatite, Taos County, New Mexico
Sample: T = 24 deg C, after heating
_database_code_amcsd 0001014
9.233 9.233 9.243 90 90 120 P6/mcc
atom      x     y     z occ B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Be2      .5     0   .25 .86  .0021  .0026  .0018  .0013      0      0
Li2      .5     0   .25 .13  .0021  .0026  .0018  .0013      0      0
Al2      .5     0   .25 .01  .0021  .0026  .0018  .0013      0      0
Al      2/3   1/3   .25      .0017  .0017  .0017 .00085      0      0
Si1   .3891 .1186     0 .98  .0013  .0012  .0014  .0006      0      0
Al1   .3891 .1186     0 .02  .0013  .0012  .0014  .0006      0      0
O1    .3055 .2351     0      .0028  .0022  .0051  .0018      0      0
O2    .4982 .1468 .1447      .0038  .0040  .0026  .0024 -.0018 -.0014
WatC1     0     0   .25 .55  .0067  .0067  .0052 .00335      0      0
CsC1      0     0   .25 .09  .0067  .0067  .0052 .00335      0      0
KC1       0     0   .25 .05  .0067  .0067  .0052 .00335      0      0
NaC2      0     0     0 .21  .0059  .0059  .0029 .00295      0      0
CaC2      0     0     0 .02  .0059  .0059  .0029 .00295      0      0
MgC2      0     0     0 .02  .0059  .0059  .0029 .00295      0      0
FeC2      0     0     0 .01  .0059  .0050  .0029 .00295      0      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Hazen R M, Au A Y, Finger L W
Download am/vol71/AM71_977.pdf
American Mineralogist 71 (1986) 977-984
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH)
Sample: Pressure = .001 kbar
_database_code_amcsd 0001040
9.208 9.208 9.188 90 90 120 P6/mcc
atom     x     y     z Biso
Be      .5     0   .25  .57
Al     1/3   2/3   .25  .51
Si   .3876 .1159     0  .44
O1   .3103 .2369     0  .82
O2   .4985 .1456 .1453  .68
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Hazen R M, Au A Y, Finger L W
Download am/vol71/AM71_977.pdf
American Mineralogist 71 (1986) 977-984
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH)
Sample: Pressure = 18 kbar
_database_code_amcsd 0001041
9.179 9.179 9.157 90 90 120 P6/mcc
atom     x     y     z Biso
Be      .5     0   .25   .3
Al     1/3   2/3   .25   .9
Si   .3882 .1155     0  .68
O1   .3122 .2376     0  .58
O2   .4987 .1459 .1449  .78
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Hazen R M, Au A Y, Finger L W
Download am/vol71/AM71_977.pdf
American Mineralogist 71 (1986) 977-984
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH)
Sample: Pressure = 36 kbar
_database_code_amcsd 0001042
9.153 9.153 9.119 90 90 120 P6/mcc
atom     x     y     z Biso
Be      .5     0   .25   .4
Al     1/3   2/3   .25  1.1
Si   .3883 .1161     0  .87
O1   .3111 .2371     0 1.06
O2   .4984 .1450 .1447  .98
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Hazen R M, Au A Y, Finger L W
Download am/vol71/AM71_977.pdf
American Mineralogist 71 (1986) 977-984
High-pressure crystal chemistry of beryl (Be3Al2Si6O18) and euclase (BeAlSiO4OH)
Sample: Pressure = 57 kbar
_database_code_amcsd 0001043
9.127 9.127 9.064 90 90 120 P6/mcc
atom     x     y     z Biso
Be      .5     0   .25   .8
Al     1/3   2/3   .25  1.0
Si   .3893 .1166     0  .95
O1   .3107 .2366     0  .30
O2   .4992 .1452 .1470  .72
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 3
Locality: Mount Cervandone, Val d'Ossola, Piedmont, Italy
_database_code_amcsd 0001172
9.2736 9.2736 9.1910 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3852 .1122     0            .0062  .0063  .0016  .0034      0      0
Be      .5     0   .25 .953 .006
Li      .5     0   .25 .009 .006
Si2     .5     0   .25 .037 .006
Al1     .5     0   .25 .001 .006
Al2    2/3   1/3   .25 .654       .0084  .0084  .0049  .0042      0      0
Fe1    2/3   1/3   .25 .037       .0084  .0084  .0049  .0042      0      0
Fe2    2/3   1/3   .25 .146       .0084  .0084  .0049  .0042      0      0
Mg     2/3   1/3   .25 .164       .0084  .0084  .0049  .0042      0      0
O1   .3062 .2315     0            .0147  .0141  .0147  .0114      0      0
O2   .4951 .1418 .1450            .0130  .0135  .0045  .0085 -.0024 -.0001
Na       0     0   .25 .406       .0580  .0580  .0323  .0290      0      0
Cs       0     0   .25 .012       .0580  .0580  .0323  .0290      0      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 1
Locality: Calcaferro mine, Pietrasanta, Tuscany, Italy
_database_code_amcsd 0001173
9.2666 9.2666 9.1874 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3858 .1130     0            .0036  .0033  .0045  .0019      0      0
Be      .5     0   .25 .972 .006
Li      .5     0   .25 .009 .006
Si2     .5     0   .25 .009 .006
Al1     .5     0   .25 .016 .006
Al2    2/3   1/3   .25 .763       .0043  .0043  .0073  .0021      0      0
Fe     2/3   1/3   .25  .15       .0043  .0043  .0073  .0021      0      0
Mg     2/3   1/3   .25 .088       .0043  .0043  .0073  .0021      0      0
O1   .3050 .2311     0            .0127  .0102  .0197  .0097      0      0
O2   .4956 .1429 .1452            .0116  .0113  .0073  .0078 -.0026 -.0006
Na       0     0   .25 .425       .0499  .0499  .0319  .0249      0      0
Download AMC data (View Text File)
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 2
Locality: Calcaferro mine, Pietrasanta, Tuscany, Italy
_database_code_amcsd 0001174
9.2676 9.2676 9.1945 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3858 .1128     0            .0041  .0038  .0036  .0023      0      0
Be      .5     0   .25 .981 .006
Li      .5     0   .25 .006 .006
Si2     .5     0   .25 .012 .006
Al1     .5     0   .25 .001 .006
Al2    2/3   1/3   .25 .745       .0053  .0053  .0057  .0026      0      0
Fe1    2/3   1/3   .25 .006       .0053  .0053  .0057  .0026      0      0
Fe2    2/3   1/3   .25 .081       .0053  .0053  .0057  .0026      0      0
Mg     2/3   1/3   .25  .17       .0053  .0053  .0057  .0026      0      0
O1   .3045 .2305     0            .0122  .0099  .0178  .0089      0      0
O2   .4951 .1424 .1451            .0109  .0106  .0064  .0068 -.0027 -.0006
Na       0     0   .25 .443       .0709  .0709  .0431  .0354      0      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 6
Locality: Mohave county, Arizona, USA
_database_code_amcsd 0001175
9.2531 9.2531 9.1918 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3863 .1139     0            .0051  .0046  .0036  .0026      0      0
Be      .5     0   .25 .959 .008
Li      .5     0   .25 .033 .008
Si2     .5     0   .25 .008 .008
Al     2/3   1/3   .25 .826       .0064  .0064  .0063  .0032      0      0
Fe1    2/3   1/3   .25  .02       .0064  .0064  .0063  .0032      0      0
Fe2    2/3   1/3   .25 .097       .0064  .0064  .0063  .0032      0      0
Mg     2/3   1/3   .25 .058       .0064  .0064  .0063  .0032      0      0
O1   .3064 .2326     0            .0143  .0120  .0172  .0103      0      0
O2   .4960 .1434 .1451            .0123  .0115  .0067  .0073 -.0026 -.0009
Na       0     0   .25 .315       .0321  .0321  .0239  .0161      0      0
Cs       0     0   .25  .04       .0321  .0321  .0239  .0161      0      0
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 24
Note: U(1,2) for Na altered to match symmetry constraints.
Locality: Morrua, Zambesia
_database_code_amcsd 0001176
9.2367 9.2367 9.1903 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3867 .1142     0            .0045  .0045  .0034  .0023      0      0
Be      .5     0   .25 .966 .006
Li      .5     0   .25 .005 .006
Si2     .5     0   .25 .003 .006
Al1     .5     0   .25 .026 .006
Al2    2/3   1/3   .25  .84       .0042  .0042  .0039  .0021      0      0
Fe     2/3   1/3   .25 .032       .0042  .0042  .0039  .0021      0      0
Mg     2/3   1/3   .25 .129       .0042  .0042  .0039  .0021      0      0
O1   .3070 .2332     0            .0122  .0108  .0151  .0090      0      0
O2   .4968 .1442 .1452            .0107  .0094  .0053  .0059 -.0026 -.0004
OH       0     0     0   .9
Na       0     0   .25 .243       .0393  .0393  .0256 .01965      0      0
Download AMC data (View Text File)
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 7
Locality: Violet Claims, Wah Wah Mountains, Beaver County, Utah, USA
_database_code_amcsd 0001177
9.2364 9.2364 9.1933 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3864 .1147     0            .0045  .0041  .0031  .0023      0      0
Be      .5     0   .25  .98 .006
Li      .5     0   .25 .004 .006
Si2     .5     0   .25 .015 .006
Al1     .5     0   .25 .001 .006
Al2    2/3   1/3   .25 .859       .0050  .0050  .0036  .0025      0      0
Fe1    2/3   1/3   .25 .015       .0050  .0050  .0036  .0025      0      0
Fe2    2/3   1/3   .25 .071       .0050  .0050  .0036  .0025      0      0
Mn     2/3   1/3   .25 .025       .0050  .0050  .0036  .0025      0      0
Mg     2/3   1/3   .25 .012       .0050  .0050  .0036  .0025      0      0
Ti     2/3   1/3   .25 .019       .0050  .0050  .0036  .0025      0      0
O1   .3095 .2359     0            .0113  .0090  .0129  .0074      0      0
O2   .4976 .1445 .1451            .0091  .0075  .0055  .0046 -.0024 -.0005
Na       0     0   .25 .053       .0056  .0056  .0567  .0028      0      0
K        0     0   .25 .026       .0056  .0056  .0567  .0028      0      0
Cs       0     0   .25 .013       .0056  .0056  .0567  .0028      0      0
Rb       0     0   .25 .003       .0056  .0056  .0567  .0028      0      0
Download AMC data (View Text File)
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 8
Locality: Violet Claims, Wah Wah Mountains, Beaver County, Utah, USA
_database_code_amcsd 0001178
9.2242 9.2242 9.1934 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3870 .1154     0            .0037  .0036  .0038  .0020      0      0
Be      .5     0   .25 .988 .005
Li      .5     0   .25 .005 .005
Si2     .5     0   .25 .002 .005
Al1     .5     0   .25 .004 .005
Al2    2/3   1/3   .25 .954       .0041  .0041  .0043  .0021      0      0
Fe1    2/3   1/3   .25 .002       .0041  .0041  .0043  .0021      0      0
Fe2    2/3   1/3   .25 .039       .0041  .0041  .0043  .0021      0      0
Mn     2/3   1/3   .25 .007       .0041  .0041  .0043  .0021      0      0
O1   .3095 .2362     0            .0102  .0080  .0129  .0066      0      0
O2   .4983 .1451 .1451            .0079  .0058  .0061  .0032 -.0023 -.0004
Na       0     0   .25 .061       .0258  .0258  .1033  .0129      0      0
Cs       0     0   .25 .015       .0258  .0258  .1033  .0129      0      0
Rb       0     0   .25 .002       .0258  .0258  .1033  .0129      0      0
Download AMC data (View Text File)
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View JMOL 3-D Structure (permalink)
 
Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 12
Note: U(1,2) for Na altered to match symmetry constraints.
Locality: Karoi, Miami district, Zimbabwe
_database_code_amcsd 0001179
9.2202 9.2202 9.1960 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3875 .1160     0            .0031  .0027  .0035  .0016      0      0
Be      .5     0   .25 .979 .006
Li      .5     0   .25  .01 .006
Si2     .5     0   .25 .008 .006
Al1     .5     0   .25 .003 .006
Al2    2/3   1/3   .25 .954       .0037  .0037  .0049  .0018      0      0
Fe     2/3   1/3   .25 .046       .0037  .0037  .0049  .0018      0      0
O1   .3084 .2353     0            .0103  .0082  .0148  .0072      0      0
O2   .4982 .1453 .1449            .0080  .0067  .0064  .0043 -.0030 -.0010
Na       0     0   .25 .067       .0359  .0359  .0306 .01795      0      0
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 26
Locality: Ural Mountains, Russia
_database_code_amcsd 0001180
9.2176 9.2176 9.1968 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si   .3877 .1161     0            .0046  .0040  .0028  .0024      0      0
Be      .5     0   .25 .993 .005
Li      .5     0   .25 .006 .005
Al1     .5     0   .25 .001 .005
Al2    2/3   1/3   .25 .961       .0044  .0044  .0035  .0022      0      0
Fe     2/3   1/3   .25 .009       .0044  .0044  .0035  .0022      0      0
Mg     2/3   1/3   .25  .03       .0044  .0044  .0035  .0022      0      0
O1   .3083 .2349     0            .0117  .0086  .0130  .0081      0      0
O2   .4983 .1451 .1448            .0082  .0073  .0059  .0042 -.0028 -.0007
Na       0     0   .25 .091       .0500  .0500  .0495  .0250      0      0
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Beryl
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Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 16
Locality: Fort Victoria field, Zimbabwe
_database_code_amcsd 0001181
9.2097 9.2097 9.1943 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3876 .1158     0            .0012  .0011  .0001  .0006      0      0
Be      .5     0   .25 .995 .003
Li      .5     0   .25 .002 .003
Si2     .5     0   .25 .001 .003
Al1     .5     0   .25 .001 .003
Al2    2/3   1/3   .25 .988       .0039  .0039  .0025  .0019      0      0
Fe     2/3   1/3   .25 .012       .0039  .0039  .0025  .0019      0      0
O1   .3103 .2369     0            .0073  .0048  .0091  .0051      0      0
O2   .4989 .1456 .1452            .0050  .0031  .0033  .0023 -.0021 -.0006
Na       0     0   .25 .026       .0776  .0776  .0362  .0388      0      0
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 19
Note: U(1,2) for Na/Cs/Rb altered to match symmetry constraints.
Locality: Salinas mine, Minas Gerais, Brazil
_database_code_amcsd 0001182
9.2155 9.2155 9.2291 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3894 .1191     0            .0029  .0029  .0043  .0016      0      0
Be      .5     0   .25 .865 .007
Li      .5     0   .25 .131 .007
Si2     .5     0   .25 .001 .007
Al1     .5     0   .25 .003 .007
Al2    2/3   1/3   .25            .0032  .0032  .0045  .0016      0      0
O1   .3051 .2348     0            .0104  .0087  .0192  .0075      0      0
O2   .4981  .147 .1447            .0118  .0114  .0100  .0073 -.0057 -.0040
Na       0     0   .25 .239       .0187  .0187  .0162 .00935      0      0
Cs       0     0   .25 .131       .0187  .0187  .0162 .00935      0      0
Rb       0     0   .25 .002       .0187  .0187  .0162 .00935      0      0
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 22
Locality: Mawi mine, Nuristan, Afghanistan
_database_code_amcsd 0001183
9.2148 9.2148 9.2318 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3894 .1192     0            .0041  .0041  .0026  .0022      0      0
Be      .5     0   .25 .825 .007
Li      .5     0   .25 .166 .007
Si2     .5     0   .25 .014 .007
Al     2/3   1/3   .25 .999       .0044  .0044  .0030  .0022      0      0
O1   .3049 .2346     0            .0121  .0090  .0200  .0083      0      0
O2   .4983 .1475 .1449            .0142  .0138  .0082  .0090 -.0059 -.0046
Na       0     0   .25 .228       .0247  .0247  .0189 .01235      0      0
Cs       0     0   .25 .154       .0247  .0247  .0189 .01235      0      0
Rb       0     0   .25 .002       .0247  .0247  .0189 .01235      0      0
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: 20
Locality: Salinas mine, Minas Gerais, Brazil
_database_code_amcsd 0001184
9.2097 9.2097 9.2337 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si1  .3893 .1190     0            .0045  .0045  .0044  .0024      0      0
Be      .5     0   .25 .832 .008
Li      .5     0   .25 .156 .008
Si2     .5     0   .25 .007 .008
Al1     .5     0   .25 .005 .008
Al2    2/3   1/3   .25            .0055  .0055  .0049  .0028      0      0
O1   .3054 .2351     0            .0128  .0092  .0208  .0083      0      0
O2   .4980 .1471 .1448            .0135  .0142  .0102  .0087 -.0061 -.0046
Na       0     0   .25 .261       .0229  .0229  .0195 .01145      0      0
Cs       0     0   .25  .15       .0229  .0229  .0195 .01145      0      0
Rb       0     0   .25 .001       .0229  .0229  .0195 .01145      0      0
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: S1
Locality: synthetic, flux-fusion
_database_code_amcsd 0001185
9.2077 9.2077 9.1953 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si   .3874 .1159     0 .995       .0047  .0043  .0024  .0023      0      0
Al1  .3874 .1159     0 .005       .0047  .0043  .0024  .0023      0      0
Be      .5     0   .25  .99 .005
Al2     .5     0   .25  .01 .005
Al3    2/3   1/3   .25  .98       .0056  .0056  .0027  .0028      0      0
Fe1    2/3   1/3   .25 .009       .0056  .0056  .0027  .0028      0      0
Fe2    2/3   1/3   .25 .011       .0056  .0056  .0027  .0028      0      0
O1   .3101 .2369     0            .0113  .0086  .0108  .0068      0      0
O2   .4988 .1457 .1453            .0086  .0065  .0041  .0034 -.0020 -.0004
Na       0     0   .25 .047
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Beryl
Download hom/beryl.pdf
Aurisicchio C, Fioravanti G, Grubessi O, Zanazzi P F
Download am/vol73/AM73_826.pdf
American Mineralogist 73 (1988) 826-837
Reappraisal of the crystal chemistry of beryl
Sample: S2
Locality: synthetic, flux-fusion
_database_code_amcsd 0001186
9.2051 9.2051 9.1953 90 90 120 P6/mcc
atom     x     y     z  occ Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Si   .3873 .1157     0 .995       .0045  .0040  .0034  .0021      0      0
Al1  .3873 .1157     0 .005       .0045  .0040  .0034  .0021      0      0
Be      .5     0   .25  .99 .005
Al2     .5     0   .25  .01 .005
Al3    2/3   1/3   .25 .974       .0039  .0039  .0032 .00195      0      0
Cr     2/3   1/3   .25 .026       .0039  .0039  .0032 .00195      0      0
O1   .3100 .2366     0            .0105  .0085  .0128  .0072      0      0
O2   .4986 .1456 .1453            .0085  .0064  .0052  .0036 -.0022 -.0006
Na       0     0   .25 .024
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Beryl
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Artioli G, Rinaldi R, Stahl K, Zanazzi P F
Download am/vol78/AM78_762.pdf
American Mineralogist 78 (1993) 762-768
Structure refinements of beryl by single-crystal neutron and X-ray diffraction
Sample no. 1, morganite, probed with neutrons, T = 30 K
_database_code_amcsd 0001602
9.197 9.197 9.202 90 90 120 P6/mcc
atom     x     y     z  occ Biso
Si   .3895 .1182     0      0.34
Be      .5     0   .25 .888 0.33
Li      .5     0   .25 .105 0.33
Al     2/3   1/3   .25      0.26
O1   .3065 .2357     0      0.65
O2   .4988 .1468 .1449      0.62
OW       0     0   .25  .72  2.0
Cs       0     0   .25 .083  2.0
Na       0     0     0  .24  1.5
H     .092  .062  .316 .123  5.0
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Beryl
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Artioli G, Rinaldi R, Stahl K, Zanazzi P F
Download am/vol78/AM78_762.pdf
American Mineralogist 78 (1993) 762-768
Structure refinements of beryl by single-crystal neutron and X-ray diffraction
Sample no. 1, morganite, probed with neutrons, T = 295 K
_database_code_amcsd 0001603
9.208 9.208 9.197 90 90 120 P6/mcc
atom      x      y      z  occ Biso
Si    .3889  .1182      0      0.29
Be       .5      0    .25 .894 0.46
Li       .5      0    .25 .106 0.46
Al      2/3    1/3    .25      0.33
O1    .3062  .2351      0      0.85
O2   .49842 .14681 .14499      0.71
OW        0      0    .25  .61  3.6
Cs        0      0    .25 .083  3.6
Na        0      0      0  .24  2.1
H      .072   .090   .318 .105  4.0
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Beryl
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Artioli G, Rinaldi R, Stahl K, Zanazzi P F
Download am/vol78/AM78_762.pdf
American Mineralogist 78 (1993) 762-768
Structure refinements of beryl by single-crystal neutron and X-ray diffraction
Sample no. 1, morganite, probed with X-rays, T = 295 K
_database_code_amcsd 0001604
9.208 9.208 9.197 90 90 120 P6/mcc
atom     x     y     z  occ Biso
Si   .3880 .1165     0      0.32
Be      .5     0   .25 .894 0.60
Li      .5     0   .25 .106 0.60
Al     2/3   1/3   .25      0.35
O1   .3092 .2364     0      0.87
O2   .4988 .1459 .1454      0.62
Wat      0     0     0  .16  4.9
Cs       0     0   .25 .096  7.8
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Beryl
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Artioli G, Rinaldi R, Stahl K, Zanazzi P F
Download am/vol78/AM78_762.pdf
American Mineralogist 78 (1993) 762-768
Structure refinements of beryl by single-crystal neutron and X-ray diffraction
Sample no. 2, aquamarine, probed with neutrons, T = 295 K
_database_code_amcsd 0001605
9.218 9.218 9.197 90 90 120 P6/mcc
atom      x      y      z  occ Biso
Si    .3872  .1157      0      0.23
Be       .5      0    .25      0.45
Al      2/3    1/3    .25 .985 0.27
Fe      2/3    1/3    .25 .015 0.27
O1    .3098  .2363      0      0.69
O2   .49866 .14541 .14517      0.46
Na        0      0    .25 .016  5.0
OW        0      0    .25  .24  5.0
H         0      0   .165  .13  4.0
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Beryl
Download hom/beryl.pdf
Artioli G, Rinaldi R, Stahl K, Zanazzi P F
Download am/vol78/AM78_762.pdf
American Mineralogist 78 (1993) 762-768
Structure refinements of beryl by single-crystal neutron and X-ray diffraction
Sample no. 2, aquamarine, probed with X-rays, T = 295 K
_database_code_amcsd 0001606
9.218 9.218 9.197 90 90 120 P6/mcc
atom      x      y     z  occ Biso
Si   .38735 .11563     0      0.24
Be       .5      0   .25      0.45
Al      2/3    1/3   .25 .985 0.21
Fe      2/3    1/3   .25 .015 0.21
O1    .3099  .2365     0      0.80
O2    .4986  .1454 .1452      0.47
Wat       0      0   .25  .48  8.5
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Beryl
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Gatta G D, Nestola F, Bromiley G D, Mattauch S
Download am/vol91/AM91_29.pdf
American Mineralogist 91 (2006) 29-34
The real topological configuration of the extra-framework content in
alkali-poor beryl: a multi-methodological study
Locality: Shengus, Haramosh Mts, Gilgit, Northern Areas, Pakistan
_database_code_amcsd 0003994
9.2099 9.2099 9.1894 90 90 120 P6/mcc
atom      x      y     z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Al      2/3    1/3   .25      .0029  .0018  .0018  .0052  .0009      0      0
Be       .5      0   .25      .0057  .0065  .0039  .0059  .0019      0      0
Si    .3870  .1157     0      .0032  .0035  .0029  .0042  .0023      0      0
O1    .3096  .2361     0      .0079  .0075  .0074  .0119  .0059      0      0
O2    .4987  .1454 .1452      .0056  .0064  .0046  .0056  .0027 -.0031 -.0016
Ow        0      0   .25  .34  .071
H    -.0287 -.0709 .3327 .056   .04
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Beryl
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Hawthorne F C, Cerny P
Download cm/vol15/CM15_414.pdf
The Canadian Mineralogist 15 (1977) 414-421
The alkali-metal positions in Cs-Li beryl
_database_code_amcsd 0005142
9.212 9.212 9.236 90 90 120 P6/mcc
atom     x     y     z  occ Biso B(1,1) B(2,2) B(3,3) B(1,2) B(1,3) B(2,3)
Si   .3892 .1189     0 .993       .0025  .0025  .0014  .0013      0      0
Be      .5     0   .25 .871       .0042  .0020  .0016  .0010      0      0
Li      .5     0   .25 .129       .0042  .0020  .0016  .0010      0      0
Al     2/3   1/3   .25            .0029  .0029  .0014 .00145      0      0
O1   .3048 .2352     0            .0053  .0043  .0039  .0032      0      0
O2   .4983 .1473 .1445            .0048  .0054  .0024  .0030 -.0016 -.0013
Na       0     0     0 .313  2.5
K        0     0     0 .033  2.5
Rb       0     0     0 .006  2.5
Ca       0     0     0 .003  2.5
Li       0     0     0 .049  2.5
Cs       0     0   .25 .134  2.5
Wat      0     0   .25  .66  2.5
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Beryl
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Sherriff B L, Grundy H D, Hartman J S, Hawthorne F C, Cerny P
Download cm/vol29/CM29_271.pdf
The Canadian Mineralogist 29 (1991) 271-285
The incorporation of alkalis in beryl: multi-nuclear MAS NMR
and crystal-structure study
Sample: SHEE-1-6
Locality: SHEE-1 pegmatite dike, eastern end of Shatford Lake, southeastern Manitoba, Canada
_database_code_amcsd 0005258
9.206 9.206 9.185 90 90 120 P6/mcc
atom     x     y     z occ  Uiso
Si   .3875 .1158     0     .0029
Be     1/2     0   1/4     .0057
Al     2/3   1/3   1/4 .98 .0046
Fe     2/3   1/3   1/4 .02 .0046
O1   .3095 .2362     0     .0080
O2   .4987 .1454 .1454     .0053
Na       0     0     0 .03 .0150
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Beryl
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Sherriff B L, Grundy H D, Hartman J S, Hawthorne F C, Cerny P
Download cm/vol29/CM29_271.pdf
The Canadian Mineralogist 29 (1991) 271-285
The incorporation of alkalis in beryl: multi-nuclear MAS NMR
and crystal-structure study
Sample: EEE-10
Locality: Bernic Lake, Manitoba, Canada
_database_code_amcsd 0005259
9.202 9.202 9.207 90 90 120 P6/mcc
atom     x     y     z occ  Uiso
Si   .3888 .1181     0     .0051
Be     1/2     0   1/4 .93 .0094
Li     1/2     0   1/4 .07 .0094
Al     2/3   1/3   1/4     .0054
O1   .3064 .2354     0     .0119
O2   .4984 .1468 .1448     .0102
Na       0     0     0 .23 .0129
Li       0     0     0 .33 .0129
Cs       0     0   1/4 .08 .0484
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Beryl
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Sherriff B L, Grundy H D, Hartman J S, Hawthorne F C, Cerny P
Download cm/vol29/CM29_271.pdf
The Canadian Mineralogist 29 (1991) 271-285
The incorporation of alkalis in beryl: multi-nuclear MAS NMR
and crystal-structure study
Sample: BLM503
Locality: Bernic Lake, Manitoba, Canada
_database_code_amcsd 0005260
9.210 9.210 9.230 90 90 120 P6/mcc
atom     x     y     z occ  Uiso
Si   .3890 .1185     0     .0042
Be     1/2     0   1/4 .90 .0088
Li     1/2     0   1/4 .10 .0088
Al     2/3   1/3   1/4     .0052
O1   .3060 .2354     0     .0117
O2   .4982 .1469 .1448     .0103
Na       0     0     0 .19 .0217
Li       0     0     0 .32 .0217
Cs       0     0   1/4 .11 .0367
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Beryl
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Sherriff B L, Grundy H D, Hartman J S, Hawthorne F C, Cerny P
Download cm/vol29/CM29_271.pdf
The Canadian Mineralogist 29 (1991) 271-285
The incorporation of alkalis in beryl: multi-nuclear MAS NMR
and crystal-structure study
Sample: T-24
Locality: Bernic Lake, Manitoba, Canada
_database_code_amcsd 0005261
9.228 9.228 9.240 90 90 120 P6/mcc
atom     x     y     z occ  Uiso
Si   .3893 .1192     0     .0070
Be     1/2     0   1/4 .85 .0122
Li     1/2     0   1/4 .15 .0122
Al     2/3   1/3   1/4     .0054
O1   .3043 .2349     0     .0147
O2   .4985 .1477 .1466     .0145
Na       0     0     0 .28 .0251
Li       0     0     0 .01 .0251
Cs       0     0   1/4 .15 .0389
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Beryl
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Groat L A, Rossman G R, Dyar M D, Turner D, Piccoli P M B,
Schultz A J, Ottolini L
 
The Canadian Mineralogist 48 (2010) 597-613
Crystal chemistry of dark blue aquamarine from the True Blue showing,
Yukon Territory, Canada
Note: X-ray
Locality: True Blue showing, Yukon Territory, Canada
_database_code_amcsd 0006282
9.2909 9.2909 9.1996 90 90 120 P6/mcc
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Be       .5      0    .25      .0087  .0096   .008  .0078  .0041      0      0
Al      1/3    2/3    .25 .678 .0058  .0055  .0055  .0065  .0027      0      0
Mg      1/3    2/3    .25 .129 .0058  .0055  .0055  .0065  .0027      0      0
Fe      1/3    2/3    .25 .192 .0058  .0055  .0055  .0065  .0027      0      0
Si   .38506 .11197      0      .0057  .0060  .0055  .0059  .0031      0      0
O1    .3044  .2300      0      .0138  .0144  .0121  .0194  .0100      0      0
O2   .49435 .14133 .14509      .0106  .0134  .0130  .0079  .0084 -.0024 -.0003
Na        0      0      0 .425  .017   .011   .011   .028  .0055      0      0
OW        0      0    .25 .912  .049   .060   .060   .028   .030      0      0
H        .0    .09    .19 .912   .05
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Beryl
Download hom/beryl.pdf
Groat L A, Rossman G R, Dyar M D, Turner D, Piccoli P M B,
Schultz A J, Ottolini L
 
The Canadian Mineralogist 48 (2010) 597-613
Crystal chemistry of dark blue aquamarine from the True Blue showing,
Yukon Territory, Canada
Note: neutron
Locality: True Blue showing, Yukon Territory, Canada
_database_code_amcsd 0006283
9.258 9.258 9.156 90 90 120 P6/mcc
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Be       .5      0    .25      .0073  .0078  .0074  .0067  .0037      0      0
Al      1/3    2/3    .25 .678 .0056  .0056  .0056  .0056  .0028      0      0
Mg      1/3    2/3    .25 .129 .0056  .0056  .0056  .0056  .0028      0      0
Fe      1/3    2/3    .25 .192 .0056  .0056  .0056  .0056  .0028      0      0
Si    .3855  .1123      0      .0052  .0057  .0052  .0050  .0029      0      0
O1    .3047  .2302      0      .0113  .0118  .0112  .0151  .0089      0      0
O2   .49500 .14196 .14519      .0089  .0110  .0124  .0061  .0080 -.0011 -.0006
Na        0      0      0 .432  .011   .009   .009   .015   .004      0      0
OW        0      0    .25 .912 .0186   .021   .021   .014  .0105      0      0
H      .025   .094   .181 .912  .052
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Beryllium
 
Yang Y W, Coppens P
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7673&volume=34&spage=61
Acta Crystallographica A34 (1978) 61-65
The electron density and bonding in beryllium metal as studied by
Fourier methods
Locality: synthetic
_database_code_amcsd 0009324
2.2858 2.2858 3.5843 90 90 120 P6_3/mmc
atom   x   y   z U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Be   1/3 2/3 .75  .0072  .0072  .0066  .0036      0      0
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Beryllium
 
Larsen F K, Hansen N K
Download http://scripts.iucr.org/cgi-bin/openurl?genre=article&issn=0108-7681&volume=40&spage=169
Acta Crystallographica B40 (1984) 169-179
Diffraction study of the electron density distribution in beryllium metal
Locality: Synthetic
_database_code_amcsd 0020596
2.2853 2.2853 3.5842 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Wyckoff R W G
 
Crystal Structures 1 (1963) 7-83
Second edition. Interscience Publishers, New York, New York
Hexagonal closest packed, hcp, structure
_database_code_amcsd 0011165
2.2866 2.2866 3.5833 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryl
Download hom/beryl.pdf
Yakubivich O V, Pekov I V, Steele I M, Massa W, Chukanov N V
 
Crystallography Reports 54 (2009) 399-412
Alkali metals in beryl and their role in the formation of derivative structural motifs:
Comparative crystal chemistry of vorobyevite and pezzottaite
Locality: Lipovka pegmatite field, Rezh District, Central Urals, Urals Region, Russia
Note: T = 100 K
Note: variety vorobyevite
Note: Coordinates of O1 and O2 corrected by Yakubivich
_database_code_amcsd 0012414
9.2101 9.2101 9.2179 90 90 120 P6/mcc
atom      x       y      z  occ  Uiso
Cs        0       0    .25 .079 .0322
Wat       0       0    .25  .19 .0322
Na1       0       0      0 .155  .014
Na2    .204    .159   .231 .010  .046
Na3    .095    .118   .201 .012  .046
Li       .5       0    .25  .22 .0090
Be       .5       0    .25  .78 .0090
Al      2/3     1/3    .25      .0082
Si   .38846  .11726      0      .0083
O1   .49888  .14661 .14500      .0107
O2   .23580 -.07170      0      .0121
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 24 C
_database_code_amcsd 0012877
2.2858 2.2858 3.5842 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 25 C
_database_code_amcsd 0012878
2.2858 2.2858 3.5843 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 26.5 C
_database_code_amcsd 0012879
2.2858 2.2858 3.5843 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 74 C
_database_code_amcsd 0012880
2.2871 2.2871 3.5860 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 95 C
_database_code_amcsd 0012881
2.2875 2.2875 3.5865 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 147 C
_database_code_amcsd 0012882
2.2900 2.2900 3.5890 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 215 C
_database_code_amcsd 0012883
2.2923 2.2923 3.5918 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 239 C
_database_code_amcsd 0012884
2.2932 2.2932 3.5930 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 293 C
_database_code_amcsd 0012885
2.2958 2.2958 3.5959 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 360 C
_database_code_amcsd 0012886
2.2982 2.2982 3.5994 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 385 C
_database_code_amcsd 0012887
2.2995 2.2995 3.6009 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 423 C
_database_code_amcsd 0012888
2.3008 2.3008 3.6027 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 496 C
_database_code_amcsd 0012889
2.3043 2.3043 3.6067 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 567.5 C
_database_code_amcsd 0012890
2.3078 2.3078 3.6105 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 601.5 C
_database_code_amcsd 0012891
2.3091 2.3091 3.6127 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 695 C
_database_code_amcsd 0012892
2.3140 2.3140 3.6190 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 716 C
_database_code_amcsd 0012893
2.3148 2.3148 3.6199 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 793.5 C
_database_code_amcsd 0012894
2.3189 2.3189 3.6251 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 807.5 C
_database_code_amcsd 0012895
2.3193 2.3193 3.6255 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 895 C
_database_code_amcsd 0012896
2.3241 2.3241 3.6220 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 901.5 C
_database_code_amcsd 0012897
2.3241 2.3241 3.6220 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 904.5 C
_database_code_amcsd 0012898
2.3249 2.3249 3.6227 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 989.5 C
_database_code_amcsd 0012899
2.3298 2.3298 3.6296 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 1004 C
_database_code_amcsd 0012900
2.3300 2.3300 3.6297 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Gordon P
 
Journal of Applied Physics 20 (1949) 908-917
A high temperature precision X-ray camera: some measurements of the thermal
coefficients of expansion of beryllium
Locality: synthetic
Sample: at T = 1013 C
_database_code_amcsd 0012901
2.3300 2.3300 3.6294 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = .001 GPa
Note: BeI phase
_database_code_amcsd 0013182
2.280 2.280 3.600 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 5 GPa
Note: BeI phase
_database_code_amcsd 0013183
2.2526 2.2526 3.5064 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 8.6 GPa
Note: BeI phase
_database_code_amcsd 0013184
2.2504 2.2504 3.4776 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 11.5 GPa
Note: BeI phase
_database_code_amcsd 0013185
2.2207 2.2207 3.4488 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 14.5 GPa
Note: BeII phase, slightly distorded HCP
_database_code_amcsd 0013186
4.4278 4.4278 3.4740 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 19.5 GPa
Note: BeII phase, slightly distorded HCP
_database_code_amcsd 0013187
4.4004 4.4004 3.4020 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 22 GPa
Note: BeII phase, slightly distorded HCP
_database_code_amcsd 0013188
4.3799 4.3799 3.3912 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 25.5 GPa
Note: BeII phase, slightly distorded HCP
_database_code_amcsd 0013189
4.3571 4.3571 3.4020 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
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Beryllium
 
Ming L C, Manghnani M H
 
Journal of Physics F: Metal Physics 14 (1984) 1-8
Isothermal compression and phase transition in beryllium to 28.3 GPa
Locality: synthetic
Sample: at P = 28.3 GPa
Note: BeII phase, slightly distorded HCP
_database_code_amcsd 0013190
4.3890 4.3890 3.3768 90 90 120 P6_3/mmc
atom   x   y   z
Be   1/3 2/3 .25
Download AMC data (View Text File)
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Beryllium
 
Vijayakumar V, Godwal B K, Vohra Y K, Sikka S K, Chidambaram R
 
Journal of Physics F: Metal Physics 14 (1984) L65-L68
On the high-pressure phase transition in beryllium metal
Locality: synthetic
Sample: at P = 28.3 GPa
Note: phase II
_database_code_amcsd 0013191
2.168 3.755 3.416 90 90 90 P2_12_12
atom   x   y   z
Be   .67 .82 .70
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Beryl
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Gibbs G V, Breck D W, Meagher E P
 
Lithos 1 (1968) 275-285
Structural refinement of hydrous and anhydrous synthetic beryl,
Al2(Be3Si6)O18 and emerald, Al1.9Cr0.1(Be3Si6)O18
Note: anhydrous beryl
Locality: synthetic
_database_code_amcsd 0019466
9.212 9.212 9.187 90 90 120 P6/mcc
atom     x     y     z Biso
Al     2/3   1/3   .25  .30
Be      .5     0   .25  .27
Si   .3875 .1159     0  .21
O1   .3109 .2375     0  .55
O2   .4992 .1462 .1450  .37
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Beryl
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Gibbs G V, Breck D W, Meagher E P
 
Lithos 1 (1968) 275-285
Structural refinement of hydrous and anhydrous synthetic beryl,
Al2(Be3Si6)O18 and emerald, Al1.9Cr0.1(Be3Si6)O18
Note: hydrous beryl
Locality: synthetic
_database_code_amcsd 0019467
9.213 9.213 9.206 90 90 120 P6/mcc
atom     x     y     z Biso
Al     2/3   1/3   .25  .15
Be      .5     0   .25  .33
Si   .3874 .1159     0  .11
O1   .3101 .2366     0  .47
O2   .4996 .1458 .1454  .28
Wat      0     0   .25   10
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Beryl
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Gibbs G V, Breck D W, Meagher E P
 
Lithos 1 (1968) 275-285
Structural refinement of hydrous and anhydrous synthetic beryl,
Al2(Be3Si6)O18 and emerald, Al1.9Cr0.1(Be3Si6)O18
Note: anhydrous emerald
Locality: synthetic
_database_code_amcsd 0019468
9.219 9.219 9.198 90 90 120 P6/mcc
atom     x     y     z occ Biso
Al     2/3   1/3   .25 .95  .43
Cr     2/3   1/3   .25 .05  .43
Be      .5     0   .25      .23
Si   .3875 .1160     0      .11
O1   .3120 .2373     0      .38
O2   .4993 .1456 .1450      .27
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Beryl
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Gibbs G V, Breck D W, Meagher E P
 
Lithos 1 (1968) 275-285
Structural refinement of hydrous and anhydrous synthetic beryl,
Al2(Be3Si6)O18 and emerald, Al1.9Cr0.1(Be3Si6)O18
Note: hydrous emerald
Locality: synthetic
_database_code_amcsd 0019469
9.214 9.214 9.218 90 90 120 P6/mcc
atom     x     y     z occ Biso
Al     2/3   1/3   .25 .95  .48
Cr     2/3   1/3   .25 .05  .48
Be      .5     0   .25      .24
Si   .3872 .1154     0      .09
O1   .3106 .2365     0      .50
O2   .4993 .1456 .1449      .26
Wat      0     0   .25        9
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Beryl
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Adamo I, Gatta G D, Rotiroti N, Diella V, Pavese A
 
Mineralogical Magazine 72 (2008) 799-808
Gemmological investigation of a synthetic blue beryl: a multi-methodological study
Note: Sample: M2-1
Locality: synthetic
_database_code_amcsd 0019164
9.2502 9.2502 9.2184 90 90 120 P6/mcc
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Be       .5      0    .25 .953 .0088  .0126   .005   .006  .0025      0      0
Cu       .5      0    .25 .047 .0088  .0126   .005   .006  .0025      0      0
Al      2/3    1/3    .25 .942 .0055  .0061  .0061  .0042  .0031      0      0
Fe      2/3    1/3    .25 .058 .0055  .0061  .0061  .0042  .0031      0      0
Si   .38706 .11623      0      .0057  .0060  .0061  .0054  .0033      0      0
O1   .30799 .23577      0      .0130  .0120  .0108   .019  .0077      0      0
O2   .49789 .14549 .14496      .0104  .0128  .0107  .0094  .0071 -.0039 -.0026
Wat       0      0    .25  .44   .08
LiM       0      0      0  .12   .07
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Beryl
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Adamo I, Gatta G D, Rotiroti N, Diella V, Pavese A
 
Mineralogical Magazine 72 (2008) 799-808
Gemmological investigation of a synthetic blue beryl: a multi-methodological study
Note: Sample: M2-2
Locality: synthetic
_database_code_amcsd 0019165
9.2489 9.2489 9.2211 90 90 120 P6/mcc
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Be       .5      0    .25 .952 .0097   .012   .006  .0082  .0032      0      0
Cu       .5      0    .25 .048 .0097   .012   .006  .0082  .0032      0      0
Al      2/3    1/3    .25 .941 .0059  .0062  .0062  .0053  .0031      0      0
Fe      2/3    1/3    .25 .059 .0059  .0062  .0062  .0053  .0031      0      0
Si   .38706 .11627      0      .0063  .0064  .0060  .0067  .0033      0      0
O1   .30768 .23559      0      .0137  .0139  .0119  .0194  .0095      0      0
O2   .49762 .14536 .14492      .0112  .0135  .0120  .0102  .0079 -.0047 -.0030
Wat       0      0    .25  .49   .09
LiM       0      0      0  .12   .05
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Beryl
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Adamo I, Gatta G D, Rotiroti N, Diella V, Pavese A
 
Mineralogical Magazine 72 (2008) 799-808
Gemmological investigation of a synthetic blue beryl: a multi-methodological study
Note: Sample: M2-3
Locality: synthetic
_database_code_amcsd 0019166
9.2483 9.2483 9.2193 90 90 120 P6/mcc
atom      x      y      z  occ  Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Be       .5      0    .25 .943 .0098   .014   .006   .007  .0030      0      0
Cu       .5      0    .25 .057 .0098   .014   .006   .007  .0030      0      0
Al      2/3    1/3    .25 .946 .0058  .0064  .0064  .0046  .0032      0      0
Fe      2/3    1/3    .25 .054 .0058  .0064  .0064  .0046  .0032      0      0
Si   .38708 .11635      0      .0064  .0063  .0061  .0070  .0033      0      0
O1   .30732 .23550      0      .0140  .0149  .0114  .0193  .0093      0      0
O2   .49793 .14567 .14483      .0117  .0141  .0117  .0113  .0079  -.004 -.0030
Wat       0      0    .25  .48   .09
LiM       0      0      0  .12   .09
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Beryl
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Bragg W
 
Proceedings of the Royal Society of London A111 (1926) 691-714
The structure of beryl, Be3Al2Si6O18
_cod_database_code 1010541
_database_code_amcsd 0017446
9.21 9.21 9.17 90 90 120 P6/mcc
atom   x   y   z
Al   2/3 1/3   0
Be    .5   0   0
Si   .39 .12 .25
O1   .48 .15  .1
O2    .3 .24 .25
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Beryllonite
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Golovastikov N I
 
Soviet Physics Crystallography 6 (1962) 733-739
The crystal structure of beryllonite (NaBePO4)
Locality: Stoneham, Maine, USA
_database_code_amcsd 0015544
8.16 7.79 14.08 90 90.0 90 P2_1/n
atom    x    y    z
Na1  .248 .004 .248
Na2  .747 .472 .084
Na3  .763 .031 .069
Bel  .917 .161 .239
Be2  .103 .662 .082
Be3  .431 .165 .090
P1   .921 .788 .238
P2   .106 .291 .081
P3   .432 .790 .092
O1   .435 .266 .192
O2   .066 .268 .188
O3   .252 .774 .123
O4   .739 .253 .214
O5   .948 .253 .022
O6   .552 .252 .016
O7   .949 .664 .155
O8   .239 .171 .053
O9   .535 .664 .148
Ol0  .923 .964 .198
O11  .164 .473 .062
O12  .495 .971 .110
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Beryllonite
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Giuseppetti G, Tadini C
 
Tschermaks Mineralogische und Petrographische Mitteilungen 20 (1973) 1-12
Refinement of the crystal structure of beryllonite
_database_code_amcsd 0015643
8.178 7.818 14.114 90 90.00 90 P2_1/n
atom     x     y     z B(1,1) B(2,2) B(3,3)  B(1,2)  B(1,3)  B(2,3)
Na1  .2477 .0046 .2499 .00759 .00710 .00261 -.00025 -.00002 -.00007
Na2  .7308 .4712 .0881 .00581 .00418 .00190 -.00011  .00071 -.00041
Na3  .7737 .0305 .0682 .00391 .00552 .00141 -.00073 -.00045 -.00044
Be1  .9220 .1699 .2411 .00080  .0041 .00083 -.00003  .00011  .00036
Be2  .3991 .1693 .4190 .00312  .0030 .00118 -.00078 -.00051 -.00004
Be3  .4329  .171 .0910 .00184  .0061 .00020 -.00083  .00021  .00037
P1   .5806 .2858 .2628 .00102 .00145 .00047 -.00006 -.00007  .00002
P2   .1069 .2902 .0813 .00105 .00137 .00063 -.00011 -.00012  .00004
P3   .0689 .2887 .4084 .00088 .00119 .00054  .00016 -.00004 -.00014
O1   .4411 .2678 .1906 .00191 .00401 .00061  .00057 -.00015 -.00057
O2   .0662 .2686 .1855 .00343 .00587 .00052 -.00044 -.00011  .00044
O3   .2483 .2770 .3762 .00205 .00562 .00132  .00018  .00034 -.00003
O4   .7430 .2499 .2137 .00359 .00579 .00123  .00004  .00039  .00016
O5   .9524 .2520 .0223 .00143 .00486 .00117 -.00059 -.00027  .00013
O6   .5600 .2534 .0134 .00250 .00596 .00099 -.00071  .00015  .00036
O7   .5550 .1652 .3458 .00380 .00420 .00123  .00038  .00034  .00012
O8   .2449 .1674 .0527 .00311 .00341 .00130  .00019 -.00002 -.00023
O9   .9609 .1645 .3530 .00359 .00255 .00130  .00068 -.00002  .00022
O10  .5769 .4702 .2994 .00542 .00240 .00106  .00032  .00003 -.00006
O11  .1663 .4724 .0642 .00328 .00208 .00148  .00006  .00000  .00024
O12  .0068 .4701 .3904 .00438 .00375 .00122  .00063 -.00057  .00033
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