A first-principles machine-learning force field for heterogeneous ice nucleation on microcline feldspar-Reference-Cited by-同舟云学术

A first-principles machine-learning force field for heterogeneous ice nucleation on microcline feldspar

Published:2024 Issue: Volume: Page:
ISSN:1359-6640
Container-title:Faraday Discussions
language:en
Short-container-title:Faraday Discuss.

Author:

Piaggi Pablo M.¹^ORCID,Selloni Annabella¹^ORCID,Panagiotopoulos Athanassios Z.²^ORCID,Car Roberto¹³^ORCID,Debenedetti Pablo G.²^ORCID

Affiliation:

1. Department of Chemistry, Princeton University, Princeton, NJ 08544, USA

2. Department of Chemical and Biological Engineering, Princeton University, Princeton, NJ 08544, USA

3. Department of Physics, Princeton University, Princeton, NJ 08544, USA

Abstract

A machine-learning force field paves the way for the simulation of heterogeneous ice nucleation on microcline from first principles.

Funder

U.S. Department of Energy

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2024/FD/D3FD00100H

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