| Name: | BARITE | ||
| Specification: | [15], structure type - barite, analogue, at 21 GPa+1450oK | ||
| Formula: | CaSO4 | ||
| Symmetry Class: | orthorhombic | ||
| Space Group: | P bnm | ||
| Unit Cell Parameters: | a = 6.3365 | b = 7.5347 | c = 4.9532 | ||
| Number of Formula Unit: | Z = 4 | Unit Cell Volume, Å3: | Vc = 236.48 |
| Number of Atomic Position per full Unit Cell: | P/U = 24 | Molar Volume, cm3/mol: | Vm = 35.61 |
| Number of Reflexes used in Structure Determination: | - | X-ray density, g/cm3: | p = 3.82 |
| R-factor: | - | MU, 1/cm: | µ = 283.180 |
| Wave Length for Calculated Powder Diffraction Patterns: | Cu=1.54056 | Mass attenuation coefficient, cm2/g: | µ/p = 74.084 |
| Theta-Interval for CPDP: | T/I = 1-45 | ||