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Build, display & manipulate all kinds of crystal and molecular structures. Animate structural behaviour; generate video for teaching or presentations. Design new materials and relax their structures. Predict physical and thermodynamic properties, including vibrational spectra & lattice dynamics.
Drawing a crystal. 1. Select a pointgroup. 2. Enter unit cell properties (celldata) 3. Enter crystal forms. Smorf interactive crystals. Crystal morphology drawings of hundreds of minerals.
Generate packing diagrams of any number of unit cells in any direction, define and visualize least-squares and Miller planes, and take a slice through a crystal in any direction. Simulated diffraction patterns can be calculated for any displayed crystal structure.
VESTA is a 3D visualization program for structural models, volumetric data such as electron/nuclear densities, and crystal morphologies. Some of the novel features of VESTA are listed below. Deal with multiple structural models, volumetric data, and crystal morphologies in the same window.
CrystalMake lets you turn crude, hand-drawn molecular structures into lowest-energy three-dimensional structures. Visualize the relaxation in real time - you can even rotate your model as it relaxes.
This site is a 3D interactive introduction to fundamental crystal structures and unit cells of elemental and ionic materials. It includes simple cubic, body-centered cubic, and cubic and hexagonal close packing unit cells as well as examples showing filling of interstitial holes.
CRYSPLOT is an online web-oriented tool to visualize computed properties of periodic systems. It is targeted for plotting properties of crystalline solids computed with CRYSTAL code and in particular, one can represent band structure and density of states, among many others.
