Clarifying the role of acid and base dopants in the hydrogen-ordering phase transitions of ice

DOI

Using ISIS facilities, our team has discovered three new phases of ice: ices XIII, XIV and XV. These phases form in the presence of small amounts of hydrochloric acid. Yet, the role the acid dopant plays is still very poorly understood. In particular since the preparation of ice XI from the ‘ordinary’ ice I requires base doping and acid doping is ineffective. Now, we have found using calorimetry and X-ray diffraction that ice XIII can also be prepared with lithium hydroxide doping. Since this is the first case where acid and base doping are effective, we now have the perfect system for finally clarifying the role of the dopants. In addition to complementary DFT calculations, the experimental key question is now if acid and base dopants facilitate the same structural pathways leading towards the same ice XIII end-state. This question can only be answered with neutron diffraction.

Identifier
DOI https://doi.org/10.5286/ISIS.E.92921913
Metadata Access https://icatisis.esc.rl.ac.uk/oaipmh/request?verb=GetRecord&metadataPrefix=oai_datacite&identifier=oai:icatisis.esc.rl.ac.uk:inv/92921913
Provenance
Creator Dr Alexander Rosu-Finsen; Dr Ron Smith; Professor Christoph Salzmann
Publisher ISIS Neutron and Muon Source
Publication Year 2021
Rights CC-BY Attribution 4.0 International; https://creativecommons.org/licenses/by/4.0/
OpenAccess true
Contact isisdata(at)stfc.ac.uk
Representation
Resource Type Dataset
Discipline Chemistry; Natural Sciences; Physics
Temporal Coverage Begin 2018-05-10T07:00:00Z
Temporal Coverage End 2018-05-11T08:27:09Z