DFT calculations online on XACS cloud

Want to run DFT calculations in an easy way? Search no more!

You can easily run DFT calculations online on XACS cloud with simple inputs such as this for geometry optimization. We also provide extensive online tutorials guiding you through various types of calculations such as geometry optimization, frequencies and thermochemistry, and molecular dynamics.

Registration on the XACS platform is free and simple trial calculations can be done at no cost.