CatAgent
KR
Tools
MACE-MP-0 small
MACE-MP-0 small (fast)
MACE-MP-0b3 medium
UMA-s-1p1 (OC20, Meta)
GPT-6 Luna
GPT-6 Luna
DeepSeek V4.1 Flash
Claude Sonnet 5
CO on Pt(111) sites
Bimetallic CO screen
HEA OH site scan
Rutile oxide O screen
H coverage on Pd(111)
CO on Cu facets
Calculation gallery