It is easy to find that the orange (100) plane pole is parallel to the. The first principles plane-wave pseudopotential calculations based on density functional theory were used to determine structural and electronic properties. Some of the new features in CrystalMaker X. For comparison I uploaded two images for the same orientation as output by crystal maker. The angle at the corner of the unit cell is beta-the angle between the a and c axes. CrystalMaker 6.3 CrystalMaker Software, Begbroke Science Park, Building 5, Sandy Lane, Yarnton OX5 1P5, U.K. Calculator Use Use lattice multiplication to multiply numbers and find. If you connect the centers of four nearest Ca atoms, you will get an outline of the unit cell. Look only at the Ca atoms on the front most layer of the structure.
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