Machine learning-driven molecular dynamics unveils a bulk phase transformation driving ammonia synthesis on barium hydride

A Axel Tosello Gardini U Umberto Raucci (Atomistic Simulations) M Michele Parrinello (Atomistic Simulations, Istituto Italiano di Tecnologia, Via Enrico Melen 83, 16142 Genoa, Italy)

Article Details

Volume / Issue Vol. 16, Issue 1
Published March 12, 2025
ISSN 2041-1723
Publisher Nature Portfolio

Journal Info

Nature Communications

Nature Portfolio

ISSN: 2041-1723 Open Access Life Sciences

Authors (3)

A

Axel Tosello Gardini

U

Umberto Raucci

Atomistic Simulations

M

Michele Parrinello

Atomistic Simulations, Istituto Italiano di Tecnologia, Via Enrico Melen 83, 16142 Genoa, Italy