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:

QQ group : 295488187 or 96259578(Full)

Google forum: CALYPSO Google Forum

CALYPSO Online User Guide

CALYPSO Manual ( In English)

CALYPSO Manual ( In Chinese)

Download the pamphlet of CALYPSO. (in Chinese)