|
Figure 1
Screenshot of XRDplayground. (A) Simulated XRD pattern (CsCl in black); (A1) freeze and unfreeze curves; (A2) show/hide hkl peaks. (B) Representation of the unit cell and (B1) show/hide elements of the unit cell. (C) Controls for (C1) lattice parameters, (C2) energy and (C3) crystallite size sliders. (D) Controls for (D1) atom type, (D2) adding and removing atoms, and (D3)–(D4) positioning atoms in the unit cell. |