TGMin: A global-minimum structure search program based on a constrained basin-hopping algorithm
Sign Up to like & getrecommendations! Published in 2017 at "Nano Research"
DOI: 10.1007/s12274-017-1553-z
Abstract: In this article, we introduce Tsinghua Global Minimum (TGMin) as a new program for the global minimum searching of geometric structures of gas-phase or surface-supported atomic clusters, and the constrained basin-hopping (BH) algorithm implemented in… read more here.
Keywords: search; global minimum; program; constrained basin ... See more keywords
Search for Global Minimum Structures of P2n+1+ (n = 1–15) Using xTB-Based Basin-Hopping Algorithm
Sign Up to like & getrecommendations! Published in 2021 at "Frontiers in Chemistry"
DOI: 10.3389/fchem.2021.694156
Abstract: A new program for searching global minimum structures of atomic clusters using basin-hopping algorithm based on the xTB method was developed here. The program can be performed with a much higher speed than its replacement… read more here.
Keywords: hopping algorithm; minimum structures; global minimum; program ... See more keywords