2026-10-12 https://api.researchdata.se/oai-pmh

oai:researchdata.se:2026-52/1 2026-04-30 subject:ssif:1 subject:ssif:10402 subject:ssif:10403 subject:ssif:10404 subject:ssif:10407 subject:ssif:20402 subject:ssif:20506 subject:ssif:104 subject:ssif:204 subject:ssif:205 subject:ssif:2 principal:slug:chalmers-university-of-technology

info:eu-repo/semantics/other http://purl.org/dc/dcmitype/Dataset https://doi.org/10.71870/ta34-az87 Data for: Oxidation driven lithium uptake in nickel-base alloys – Smoking gun evidence for an inner cathode under LWR conditions Data för: Oxidation driven lithium uptake in nickel-base alloys – Smoking gun evidence for an inner cathode under LWR conditions https://orcid.org/0000-0003-0816-2509 https://orcid.org/0000-0002-4268-3386 Jiaxin Chen https://orcid.org/0000-0002-6679-075X Natural Sciences Naturvetenskap Physical Chemistry Fysikalisk kemi Materials Chemistry Materialkemi Inorganic Chemistry Oorganisk kemi Theoretical Chemistry Teoretisk kemi Surface- and Corrosion Engineering Yt- och korrosionsteknik Metallurgy and Metallic Materials Metallurgi och metalliska material Data material contains (i) the final output of Density Functional Theory calculations stored in Atomic Simulation Environment (ASE) databases and (ii) Python Jupyter notebooks that were used to calculate reactions enthalpy of formation and structural parameters based on outputs stored in these databases. Datamaterialet innehåller (i) slutresultatet av beräkningar av densitetsfunktionsteori lagrade i Atomic Simulation Environment (ASE)-databaser och (ii) Python Jupyter notebooks som användes för att beräkna reaktionsentalpi för bildning och strukturella parametrar baserade på lagrade utdata i dessa databaser. info:eu-repo/semantics/openAccess https://creativecommons.org/licenses/by/4.0/ Chalmers University of Technology Chalmers tekniska högskola 2026-04-30T06:33:28.878426Z eng