Structure 9002897

9002896 << 9002897 >> 9002901

Citation: Krivovichev, S. V.; Yakovenchuk, V. N.; Burns, P. C.; Pakhomovsky, Y. A.; Menshikov, Y. P. (2003). Cafetite, Ca[Ti2O5](H2O): Crystal structure and revision of chemical formula. American Mineralogist, 88, pp. 424-429.

Formula: Ca H2 O6 Ti2

Cell parameters:

a = 4.9436 Å
b = 12.109 Å
c = 15.911 Å

α = 90°
β = 98.937°
γ = 90°

List type: interleaving

List: 2D

Molecules

CIF datablock 0, entity 1 of 2

Basis: (1;0;0 0;1;0)

Dimensionality: 2

Formula: O20 Ti8 (O5 Ti2)

Multiplicity: 1

Coordination sequences:

1, 9, 22, 43, 61, 71, 88, 99, 124, 140
1, 10, 25, 40, 55, 71, 93, 109, 119, 132
2, 14, 28, 49, 63, 78, 90, 111, 129, 146
2, 15, 28, 42, 62, 78, 93, 111, 124, 143
2, 15, 28, 45, 57, 78, 99, 111, 125, 134
3, 17, 31, 52, 65, 82, 92, 113, 130, 149
3, 19, 33, 46, 65, 82, 98, 114, 126, 146
3, 20, 34, 57, 68, 80, 99, 114, 138, 148
3, 21, 33, 48, 68, 82, 102, 117, 126, 149
4, 22, 33, 51, 62, 85, 104, 116, 131, 139
10, 22, 40, 56, 76, 86, 106, 119, 139, 154
10, 22, 43, 61, 71, 88, 99, 124, 140, 154
11, 24, 38, 53, 69, 91, 106, 122, 133, 148
11, 25, 40, 55, 71, 93, 109, 119, 132, 150

span 1 {1 1 1}

highlight edges

CIF datablock 1, entity 2 of 2