American Mineralogist Crystal Structure Database

6 matching records for this search.

Paranatrolite
Download hom/paranatrolite.pdf
Lee Y, Hriljac J A, Parise J B, Vogt T,
Download am/vol90/AM90_252.pdf
American Mineralogist 90 (2005) 252-257
Pressure-induced stabilization of ordered paranatrolite: A new
insight into the paranatrolite controversy
Sample: at P = 0.99 GPa
_database_code_amcsd 0003732
6.4800 19.293 9.8984 90 107.56 90 Cc
atom     x     y     z Uiso
Si1   .500 .3746  .000 .013
Si2   .195 .3322  .181 .013
Si3   .544 .0802  .314 .013
Al1   .936 .4645  .093 .013
Al2   .346 .2154  .402 .013
O1    .509 .0295  .436 .013
O2    .492 .0485  .159 .013
O3    .408 .1527  .293 .013
O4    .099 .1947  .442 .013
O5    .308 .2987  .336 .013
O6    .063 .2784  .059 .013
O7    .416 .3498  .134 .013
O8    .086 .4052  .224 .013
O9    .801 .1046  .355 .013
O10   .655 .4441  .040 .013
Na1A  .180 .1587  .044 .013
Na1B  .587 .0998 -.053 .013
Wat2A .140 .0533 -.146 .013
Wat1A .932 .0743  .115 .013
Wat1B .368 .1905 -.098 .013
Download AMC data (View Text File)
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Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Paranatrolite
Download hom/paranatrolite.pdf
Lee Y, Hriljac J A, Parise J B, Vogt T
Download am/vol91/AM91_247.pdf
American Mineralogist 91 (2006) 247-251
Pressure-induced hydration in zeolite tetranatrolite
Locality: Mt. Saint-Hilaire, Quebec, Canada
Note: P = 0.4 GPa
_database_code_amcsd 0004007
6.580 19.002 9.936 90 108.97 90 Cc
atom     x     y     z  occ Uiso
Na1   .163  .142  .028 .731 .048
Ca1   .163  .142  .028 .237 .048
Na2   .563  .076 -.077 .731 .048
Ca2   .563  .076 -.077 .237 .048
Si1   .500 .3756  .000 .537 .024
Al1   .500 .3756  .000 .463 .024
Si2  .1979 .3353 .1845 .537 .024
Al2  .1979 .3353 .1845 .463 .024
Si3  .5491 .0853 .3195 .537 .024
Al3  .5491 .0853 .3195 .463 .024
Si4  .9341 .4631 .0918 .537 .024
Al4  .9341 .4631 .0918 .463 .024
Si5  .3498 .2192 .4061 .537 .024
Al5  .3498 .2192 .4061 .463 .024
O1    .520  .036  .450      .048
O2    .458  .043  .164      .048
O3    .409  .160  .303      .048
O4    .144  .191  .462      .048
O5    .305  .299  .345      .048
O6    .056  .278  .064      .048
O7    .409  .361  .134      .048
O8    .060  .404  .210      .048
O9    .805  .107  .347      .048
O10   .668  .446  .034      .048
Wat1 -.050  .064 -.182      .048
Wat2  .933  .063  .149      .048
Wat3  .387  .185 -.056      .048
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Paranatrolite
Download hom/paranatrolite.pdf
Lee Y, Hriljac J A, Parise J B, Vogt T
Download am/vol91/AM91_247.pdf
American Mineralogist 91 (2006) 247-251
Pressure-induced hydration in zeolite tetranatrolite
Locality: Mt. Saint-Hilaire, Quebec, Canada
Note: P = 0.8 GPa
_database_code_amcsd 0004008
6.567 18.963 9.975 90 108.49 90 Cc
atom     x     y     z  occ Uiso
Na1   .156  .135  .021 .731 .039
Ca1   .156  .135  .021 .237 .039
Na2   .570  .083 -.070 .731 .039
Ca2   .570  .083 -.070 .237 .039
Si1   .500 .3756     0 .537 .016
Al1   .500 .3756     0 .463 .016
Si2  .2000 .3373 .1865 .537 .016
Al2  .2000 .3373 .1865 .463 .016
Si3  .5472 .0834 .3176 .537 .016
Al3  .5472 .0834 .3176 .463 .016
Si4  .9371 .4661 .0949 .537 .016
Al4  .9371 .4661 .0949 .463 .016
Si5  .3506 .2200 .4069 .537 .016
Al5  .3506 .2200 .4069 .463 .016
O1    .502  .032  .443      .039
O2    .456  .048  .158      .039
O3    .418  .161  .306      .039
O4    .129  .193  .451      .039
O5    .304  .300  .345      .039
O6    .041  .281  .070      .039
O7    .416  .357  .135      .039
O8    .085  .411  .215      .039
O9    .807  .101  .353      .039
O10   .674  .444  .045      .039
Wat1  .078  .045 -.165      .039
Wat2  .924  .067  .128      .039
Wat3  .357  .183 -.087   .5 .039
Wat4  .621  .194  .123   .5 .039
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Paranatrolite
Download hom/paranatrolite.pdf
Lee Y, Hriljac J A, Parise J B, Vogt T
Download am/vol91/AM91_247.pdf
American Mineralogist 91 (2006) 247-251
Pressure-induced hydration in zeolite tetranatrolite
Locality: Mt. Saint-Hilaire, Quebec, Canada
Note: P = 1.1 GPa
_database_code_amcsd 0004009
6.556 18.950 9.972 90 108.47 90 Cc
atom     x     y     z  occ Uiso
Na1   .158  .137  .023 .731 .048
Ca1   .158  .137  .023 .237 .048
Na2   .566  .079 -.075 .731 .048
Ca2   .566  .079 -.075 .237 .048
Si1   .500 .3757  .000 .537 .016
Al1   .500 .3757  .000 .463 .016
Si2  .1990 .3363 .1855 .537 .016
Al2  .1990 .3363 .1855 .463 .016
Si3  .5473 .0835 .3177 .537 .016
Al3  .5473 .0835 .3177 .463 .016
Si4  .9357 .4647 .0934 .537 .016
Al4  .9357 .4647 .0934 .463 .016
Si5  .3491 .2185 .4053 .537 .016
Al5  .3491 .2185 .4053 .463 .016
O1    .502  .033  .443      .048
O2    .461  .046  .159      .048
O3    .416  .161  .303      .048
O4    .129  .192  .449      .048
O5    .303  .299  .344      .048
O6    .041  .281  .067      .048
O7    .411  .357  .132      .048
O8    .079  .409  .214      .048
O9    .808  .100  .352      .048
O10   .673  .444  .045      .048
Wat1  .104  .050 -.155      .048
Wat2  .929  .073  .119      .048
Wat3  .356  .189 -.096   .5 .048
Wat4  .598  .193  .105   .5 .048
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Paranatrolite
Download hom/paranatrolite.pdf
Lee Y, Hriljac J A, Parise J B, Vogt T
Download am/vol91/AM91_247.pdf
American Mineralogist 91 (2006) 247-251
Pressure-induced hydration in zeolite tetranatrolite
Locality: Mt. Saint-Hilaire, Quebec, Canada
Note: P = 2.5 GPa
_database_code_amcsd 0004010
6.512 18.850 9.901 90 108.73 90 Cc
atom     x     y     z  occ Uiso
Na1   .156  .135  .021 .731 .030
Ca1   .156  .135  .021 .237 .030
Na2   .569  .082 -.071 .731 .030
Ca2   .569  .082 -.071 .237 .030
Si1   .500 .3803  .000 .537 .054
Al1   .500 .3803  .000 .463 .054
Si2  .1989 .3362 .1854 .537 .054
Al2  .1989 .3362 .1854 .463 .054
Si3  .5493 .0855 .3197 .537 .054
Al3  .5493 .0855 .3197 .463 .054
Si4  .9350 .4640 .0927 .537 .054
Al4  .9350 .4640 .0927 .463 .054
Si5  .3479 .2173 .4042 .537 .054
Al5  .3479 .2173 .4042 .463 .054
O1    .475  .035  .434      .030
O2    .472  .047  .158      .030
O3    .442  .166  .304      .030
O4    .137  .183  .446      .030
O5    .289  .299  .346      .030
O6    .044  .278  .067      .030
O7    .414  .355  .132      .030
O8    .076  .408  .214      .030
O9    .814  .093  .352      .030
O10   .665  .450  .057      .030
Wat1  .065  .061 -.130      .030
Wat2  .937  .074  .115      .030
Wat3  .353  .171 -.112   .5 .030
Wat4  .761  .178  .194   .5 .030
Download AMC data (View Text File)
Download CIF data (View Text File)
Download diffraction data (View Text File)
View JMOL 3-D Structure (permalink)
 
Paranatrolite
Download hom/paranatrolite.pdf
Seryotkin Y V, Bakakin V V, Belitsky I A
 
European Journal of Mineralogy 16 (2004) 545-550
The crystal structure of paranatrolite
_database_code_amcsd 0007077
18.971 19.204 6.5952 90 91.601 90 Fd
atom        x       y     z  occ  Uiso
Na1   -.02490  .21593 .4035 .973 .0281
Na10   .03054  .27995 .8792 .977 .0319
K       .1297   .3799 .3780 .229 .0334
SiT1    .0000  .00342 .0000  .59 .0093
AlT1    .0000  .00342 .0000  .41 .0093
SiT21 -.08739  .04280 .3711  .60 .0099
AlT21 -.08739  .04280 .3711  .40 .0099
SiT22  .09389 -.04350 .3878  .60 .0087
AlT22  .09389 -.04350 .3878  .40 .0087
AlT23  .04920  .08768 .6238  .51 .0097
SiT23  .04920  .08768 .6238  .49 .0097
AlT24 -.03967 -.08993 .6133  .53 .0097
SiT24 -.03967 -.08993 .6133  .47 .0097
O1      .0236  .07177 .8627      .0192
O10    -.0190 -.06543 .8547      .0189
O2     .08596  .16672 .6247      .0154
O20   -.07726 -.16908 .6194      .0152
O3     .10458  .02504 .5421      .0177
O30   -.09452 -.03133 .5027      .0207
O4    -.02269  .09221 .4686      .0226
O40    .03522 -.09895 .4819      .0197
O5    -.07142  .02389 .1289      .0187
O50    .06725 -.01674 .1582      .0191
Ow6     .0573   .1969 .1332  .98 .0304
H61      .098    .200  .199  .98  .032
H62      .044    .157  .096  .98   .06
Ow60   -.0482   .3184  .608 .359  .048
H601    -.076    .281  .667  .36   .00
H602    -.064    .335  .474  .36   .03
Ow7     .0332   .3168 .5166 .685  .046
H71      .081    .326  .499  .68  .003
H72      .003    .361   .49  .68   .13
Ow70   -.0616   .2033 .7764 .997  .052
H701    -.086    .166  .704        .22
H702    -.061    .197  .922       .032
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: 6
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