Electrofreezing of Liquid Ammonia
Overview
Affiliations
Here we prove that, in addition to temperature and pressure, another important thermodynamic variable permits the exploration of the phase diagram of ammonia: the electric field. By means of (path integral) molecular dynamics simulations, we predict that, upon applying intense electric fields on ammonia, the electrofreezing phenomenon occurs, leading the liquid toward a novel ferroelectric solid phase. This study proves that electric fields can generally be exploited as the access key to otherwise-unreachable regions in phase diagrams, unveiling the existence of new condensed-phase structures. Furthermore, the reported findings have manifold practical implications, from the safe storage and transportation of ammonia to the understanding of the solid structures this compound forms in planetary contexts.
My Vision of Electric-Field-Aided Chemistry in 2050.
Shaik S ACS Phys Chem Au. 2024; 4(3):191-201.
PMID: 38800723 PMC: 11117677. DOI: 10.1021/acsphyschemau.3c00064.
The Reactivity-Enhancing Role of Water Clusters in Ammonia Aqueous Solutions.
Cassone G, Saija F, Sponer J, Shaik S J Phys Chem Lett. 2023; 14(35):7808-7813.
PMID: 37623433 PMC: 10494223. DOI: 10.1021/acs.jpclett.3c01810.
Kalita S, Bergman H, Dubey K, Shaik S J Am Chem Soc. 2023; 145(6):3543-3553.
PMID: 36735972 PMC: 9936589. DOI: 10.1021/jacs.2c12305.