| Name: | SHELDRICKITE | ||
| Specification: | [1] | ||
| Formula: | NaCa3[CO3]2F3 · H2O | ||
| Symmetry Class: | trigonal | ||
| Space Group: | P 3(2) | ||
| Unit Cell Parameters: | a = 6.7260 | c = 15.0440 | ||
| Number of Formula Unit: | Z = 3 | Unit Cell Volume, Å3: | Vc = 589.40 |
| Number of Atomic Position per full Unit Cell: | P/U = 48 | Molar Volume, cm3/mol: | Vm = 118.34 |
| Number of Reflexes used in Structure Determination: | NR = 1205 | X-ray density, g/cm3: | p = 2.86 |
| R-factor: | R = 0.0460 | MU, 1/cm: | µ = 190.339 |
| Wave Length for Calculated Powder Diffraction Patterns: | Cu=1.54056 | Mass attenuation coefficient, cm2/g: | µ/p = 66.598 |
| Theta-Interval for CPDP: | T/I = 1-45 | ||