Papers for methodologies in CALYPSO package:

Crystal structure prediction:

Cluster structure prediction:

Two-Dimensional layer structure prediction:

Superhard Materials Design:

Surface reconstruction searching method:

Discussions about CALYPSO at:

For the Chinese, QQ group: 96259578

For others, the forum: https://groups.google.com/forum/#!forum/calypsocode

CALYPSO Manual ( In English)

CALYPSO Manual ( In Chinese)

Download the pamphlet of CALYPSO. (in Chinese)