255. 34-0569
BaTiOF4
Triklin
Dexp Dcal d(D) h k l
4.3000 4.2969 .0031 1 0 1
3.6400 3.6413 -.0013 -1 1 0
3.4500 3.4466 .0034 1 -1 2
2.9120 2.9100 .0020 1 1 1
2.7470 2.7450 .0020 -1 -1 2
2.6070 2.6114 -.0044 1 1 3
2.4040 2.4037 .0003 0 -2 1
2.2860 2.2866 -.0006 0 2 2
2.2180 2.2178 .0002 -1 0 6
2.1460 2.1448 .0012 2 -1 2
2.0710 2.0720 -.0010 -1 1 6
1.9330 1.9330 -.0000 -1 -2 1
A= 4.482 DA= .0008
B= 4.949 DB= .001
C= 16.238 DC= .002
GAMMA=102.39 DGAMMA= .03
BETA = 84.99 DBETA = .01
ALPHA= 93.51 DALPHA= .01
V= 350.1
256. 34-0732
alfa-{NH4}2TiO{SO4}2
Triklin
13.0000 12.9676 .0324 0 0 1
10.0000 10.0117 -.0117 0 1 1
9.5000 9.4605 .0395 0 -1 1
9.0000 9.0001 -.0001 1 0 0
6.5000 6.4838 .0162 0 0 2
4.7700 4.7680 .0020 -1 3 0
4.7200 4.7178 .0022 1 1 2
4.5000 4.5001 -.0001 2 0 0
4.3300 4.3315 -.0015 -2 0 1
4.2300 4.2292 .0008 2 -1 1
4.0800 4.0844 -.0044 0 -1 3
3.9000 3.8963 .0037 -2 1 2
A= 9.2529 DA= .0003
B= 15.110 DB= .006
C= 13.02 DC= .01
GAMMA=103.003 DGAMMA= .003
BETA = 94.23 DBETA = .01
ALPHA= 85.88 DALPHA= .08
V= 1766.6
257. 34-0825
{NH4}2TiO{SO4}2*H2O
Triklin
Dexp Dcal d(D) h k l
11.0000 11.0028 -.0028 1 0 0
10.0000 10.0133 -.0133 -1 1 0
7.5000 7.5026 -.0026 0 0 1
4.4000 4.4000 .0000 2 0 1
6.0000 6.0092 -.0092 0 -1 1
5.4000 5.4036 -.0036 -1 2 1
4.8000 4.7969 .0031 -2 1 1
4.0100 4.0121 -.0021 -2 3 0
3.8300 3.8329 -.0029 -2 3 1
3.5100 3.5080 .0020 -3 2 1
3.3400 3.3400 -.0000 3 -1 1
3.2400 3.2397 .0003 -3 3 1
A= 11.63412 DA= .00006
B= 13.55858 DB= .00007
C= 7.6408 DC= .0001
GAMMA=108.9437 DGAMMA= .0002
BETA = 94.4479 DBETA = .0002
ALPHA= 79.13416 DALPHA= .00003
V=1119.2
258. 34-0958
Na2Ti{PO4}2*3H2O
Rombik
Groupa 29,57
Dexp. Dcal. d(D) h k l
9.9400 10.0076 -.0676 0 1 0
4.1000 4.0987 .0013 0 0 2
3.8800 3.8399 .0401 2 2 0
3.6900 3.7083 -.0183 3 1 0
3.3300 3.3359 -.0059 0 3 0
3.2100 3.2136 -.0036 1 3 0
3.2100 3.2043 .0057 2 1 2
3.1700 3.1708 -.0008 0 2 2
2.7500 2.7459 .0041 2 3 1
2.7500 2.7499 .0001 3 1 2
2.5700 2.5873 -.0173 0 3 2
2.5700 2.5744 -.0044 1 1 3
2.5700 2.5599 .0101 3 3 0
2.5700 2.5695 .0005 4 2 0
a=11.977 b=10.01 c= 8.1974
da= .002 db= .01 dc= .0009
v= 982.6
259. 34-1079
Na2Ti{PO4}2
Rombik
Groupa 17
Dexp. Dcal. d(D) h k l
7.6000 7.5990 .0010 0 1 0
4.3700 4.3754 -.0054 1 1 0
3.9400 3.9362 .0038 0 1 3
3.6600 3.6633 -.0033 0 2 1
2.7600 2.7610 -.0010 0 0 5
2.5700 2.5699 .0001 1 2 3
a= 5.351 b= 7.5990 c=13.805
da= .001 db= .0001 dc= .001
V= 561.4
260. 34-1144
Na2Ti{PO4}2*H2O
Rombik
Grupa 16
Dexp. Dcal. d(D) h k l
8.3500 8.4009 .0509 0 1 1
4.4200 4.4164 -.0036 1 2 0
4.2100 4.2005 -.0095 0 2 2
4.0600 4.0516 -.0084 0 3 1
3.6600 3.6532 -.0068 0 0 3
3.5200 3.5185 -.0015 0 1 3
2.8700 2.8702 .0002 1 4 0
2.8100 2.8083 -.0017 0 4 2
2.7200 2.7221 .0021 2 2 0
2.5400 2.5425 .0025 1 4 2
2.4100 2.4077 -.0023 2 3 1
2.3200 2.3199 -.0001 0 3 4
a= 5.99 b= 13.08 c= 10.96
da=.01 db= .01 dc=.01
V= 858
261. 34-1219
NaTiH{PO4}2*4H2O
rombik
Groupa 31,59
Dexp. Dcal. d(D) h k l
10.4000 10.3910 .0090 1 0 0
4.2100 4.1962 .0138 0 3 1
4.2100 4.2171 -.0071 2 0 1
4.0600 4.0686 -.0086 2 1 1
3.6600 3.6600 .0000 2 3 0
3.3800 3.3800 .0000 3 1 0
3.3300 3.3300 .0000 1 1 2
a=10.391 b=15.470 c= 7.220
da= .001 db= .001 dc= .001
V=1160.6
262. 34-1223
NaTiH{PO4}2*H2O
Monoklin
Grupa 3
Dexp Dcal d(D) h k l
8.4300 8.4326 -.0026 -1 0 1
4.6200 4.6201 -.0001 2 1 0
3.9300 3.9288 .0012 -1 2 2
3.6500 3.6531 -.0031 2 1 2
3.5100 3.5110 -.0010 2 2 1
3.3800 3.3797 .0003 1 3 0
2.9300 2.9298 .0002 3 0 2
2.8100 2.8109 -.0009 -3 0 3
2.7200 2.7193 .0007 -3 1 3
2.5300 2.5304 -.0004 -1 1 5
2.5000 2.4997 .0003 1 0 5
a= 10.272 b= 10.742 c= 13.21 beta= 94.83
da= .001 db=.004 dc=.01 dbeta=.05
V= 1452.7
263. 34-1420
Ti{HPO4}2
Monoklin
GRUPA 3
Dexp. Dcal. d(D) h k l
9.1200 9.3392 -.2192 0 0 1
5.2000 5.2077 -.0077 2 1 0
4.4800 4.4847 -.0047 2 1 1
4.3900 4.3898 .0002 0 1 2
4.0100 4.0163 -.0063 1 3 0
3.9000 3.8999 .0001 0 3 1
3.7900 3.7961 -.0061 3 0 0
3.4200 3.4200 .0000 2 1 2
3.2700 3.2700 .0000 3 2 0
3.1600 3.1600 .0000 0 3 2
3.0000 3.0000 .0000 -3 0 2
a= 11.396 b= 12.876 c= 9.345 beta= 92.10
da=.009 db=.001 dc=.006 dbet=.02
V=1369.3 |
264. 34-1424
Dy2TiO5
Triklin
Dexp Dcal d(D) h k l
5.9400 5.9102 .0298 -2 0 1
3.1400 3.1402 -.0002 0 -1 1
3.0300 3.0307 -.0007 -1 1 1
3.0000 2.9997 .0003 1 -1 1
2.9800 2.9802 -.0002 0 1 1
2.9200 2.9210 -.0010 -2 1 0
2.7800 2.7791 .0009 0 -1 2
2.6000 2.6020 -.0020 -3 1 1
2.4640 2.4633 .0007 -3 -1 1
2.1610 2.1612 -.0002 1 0 4
1.8990 1.8978 .0012 6 0 0
1.8380 1.8385 -.0005 -6 0 4
A= 12.234 DA= .007
B= 3.249 DB= .001
C= 10.142 DC= .004
GAMMA= 93.456 DGAMMA= .001
BETA =110.89 DBETA = .01
ALPHA= 93.34 DALPHA= .04
V=374.8
265. 34-1465
Ti{HPo4}2*2H2O
Triklin
Dexp Dcal d(D) h k l
11.6200 11.6257 -.0057 1 0 1
6.6500 6.6463 .0037 1 1 1
6.1000 6.1020 -.0020 -1 -1 1
5.5600 5.5619 -.0019 -1 1 0
4.5700 4.5697 .0003 -2 -1 1
4.2900 4.2898 .0002 3 0 2
3.9600 3.9601 -.0001 2 1 3
3.8300 3.8296 .0004 2 -1 3
3.6800 3.6798 .0002 -2 -1 2
3.4600 3.4599 .0001 -3 -1 1
3.2900 3.2902 -.0002 4 1 2
3.1800 3.1802 -.0002 0 -1 4
3.0700 3.0699 .0001 1 1 4
A= 13.468 DA= .002
B= 7.7602 DB= .0009
C= 14.4623 DC= .0008
GAMMA= 76.0002 DGAMMA= .0006
BETA = 65.333 DBETA = .005
ALPHA= 93.371 DALPHA= .002
V= 1310.7
266. 34-1677
C5H5Cl3Ti
Triklin
Dexp Dcal d(D) h k l
9.9100 9.9171 -.0071 0 1 1
8.6400 8.6325 .0075 1 1 0
7.7900 7.7790 .0110 0 -1 1
7.2300 7.2325 -.0025 1 0 1
5.7200 5.7208 -.0008 0 0 2
5.2100 5.2109 -.0009 0 -2 1
4.6100 4.6102 -.0002 1 2 2
4.4000 4.3997 .0003 -2 -1 1
3.8900 3.8895 .0005 0 -2 2
3.8000 3.8005 -.0005 -1 -2 2
3.6500 3.6499 .0001 1 1 3
3.3300 3.3302 -.0002 1 4 0
3.2800 3.2801 -.0001 2 -2 1
3.2200 3.2199 .0001 0 4 2
A= 9.861 DA= .009
B= 13.874 DB= .008
C= 11.7883 DC= .0005
GAMMA= 79.39 DGAMMA= .07
BETA = 89.97 DBETA = .03
ALPHA= 76.31 DALPHA= .02
V= 1538.6
267. 34-1707
C5H5Cl3LiTi
Triklin
Dexp Dcal d(D) h k l
7.2500 7.2494 .0006 0 1 1
6.5000 6.5006 -.0006 0 -1 1
5.2400 5.2387 .0013 1 0 0
4.3000 4.2998 .0002 1 -1 1
4.2000 4.2018 -.0018 1 0 2
3.8900 3.8890 .0010 -1 -1 1
3.5300 3.5300 .0000 -1 1 2
2.9900 2.9902 -.0002 -1 0 3
2.9700 2.9701 -.0001 -1 -2 1
2.7400 2.7398 .0002 1 0 4
2.6700 2.6700 -.0000 1 1 4
2.5700 2.5700 .0000 0 2 4
A= 5.2822 DA= .0007
B= 8.4228 DB= .0004
C= 12.080 DC= .001
GAMMA= 91.746 DGAMMA= .005
BETA = 83.092 DBETA = .001
ALPHA= 83.638 DALPHA= .007
V= 529.8
268. 34-1707
C5H5Cl3LiTi
Rombik
Groupa 19
Dexp. Dcal. d(D) h k l
7.2500 7.2241 .0259 0 2 0
6.5000 6.5510 -.0510 0 0 1
5.2400 5.2159 .0241 1 0 1
4.3000 4.3104 -.0104 2 0 0
4.2000 4.2045 -.0045 1 3 0
3.8900 3.8803 .0097 0 3 1
3.5300 3.5384 -.0084 1 3 1
2.9900 2.9954 -.0054 1 1 2
2.9700 2.9695 .0005 1 4 1
2.7400 2.7398 .0002 1 5 0
2.6700 2.6701 -.0001 3 2 0
2.5700 2.5665 .0035 2 1 2
a= 8.62 b=14.448 c= 6.5510
da= .01 db= .009 dc= .0006
v= 816
Triklin
Dexp Dcal d(D) h k l
7.2500 7.2494 .0006 0 1 1
6.5000 6.5006 -.0006 0 -1 1
5.2400 5.2387 .0013 1 0 0
4.3000 4.2998 .0002 1 -1 1
4.2000 4.2018 -.0018 1 0 2
3.8900 3.8890 .0010 -1 -1 1
3.5300 3.5300 .0000 -1 1 2
2.9900 2.9902 -.0002 -1 0 3
2.9700 2.9701 -.0001 -1 -2 1
2.7400 2.7398 .0002 1 0 4
2.6700 2.6700 -.0000 1 1 4
2.5700 2.5700 .0000 0 2 4
A= 5.2822 DA= .0007
B= 8.4228 DB= .0004
C= 12.080 DC= .001
GAMMA= 91.746 DGAMMA= .005
BETA = 83.092 DBETA = .001
ALPHA= 83.638 DALPHA= .007
V= 529.8
269. 34-1737
C5H9BClTi
Triklin
Dexp Dcal d(D) h k l
7.6300 7.6227 .0073 1 0 0
6.8200 6.8118 .0082 0 1 1
6.3500 6.3448 .0052 1 0 1
5.6200 5.6254 -.0054 1 1 1
5.0900 5.0917 -.0017 -1 0 1
3.7900 3.7903 -.0003 2 0 1
3.5600 3.5599 .0001 -1 2 1
3.2100 3.2097 .0003 -2 0 1
3.1500 3.1502 -.0002 -1 -2 1
3.0900 3.0903 -.0003 -2 1 1
2.9000 2.8998 .0002 2 2 0
2.5200 2.5200 .0000 1 -1 3
A= 7.823 DA= .002
B= 9.0528 DB= .0001
C= 8.7202 DC= .0001
GAMMA= 86.65 DGAMMA= .02
BETA = 77.03 DBETA = .02
ALPHA= 77.37 DALPHA= .06
V=587.3 |
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