Pauling's rules for oxide surfaces

Andersen, Tassie K.; Fong, Dillon D.; Marks, Laurence D.

doi:10.1016/j.surfrep.2018.08.001

Title: Pauling's rules for oxide surfaces

Journal Article · Wed Sep 12 00:00:00 EDT 2018 · Surface Science Reports

DOI:https://doi.org/10.1016/j.surfrep.2018.08.001· OSTI ID:1476649

Andersen, Tassie K. ^[1]; Fong, Dillon D. ^[2]; Marks, Laurence D. ^[1]

Northwestern Univ., Evanston, IL (United States)
Argonne National Lab. (ANL), Argonne, IL (United States)

Determination of surface structures currently requires careful measurement and computationally expensive methods since, unlike bulk crystals, guiding principles for generating surface structural hypotheses are frequently lacking. In this work, we discuss the applicability of Pauling's rules as a set of guidelines for surface structures. The wealth of solved reconstructions on SrTiO₃ (100), (110), and (111) are considered, as well as nanostructures on these surfaces and a few other ABO₃ oxide materials. These rules are found to explain atomic arrangements for reconstructions and thin films just as they apply to bulk oxide materials. Lastly, using this data and Pauling's rules, the fundamental structural units of reconstructions and their arrangement are discussed.

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Research Organization:: Argonne National Laboratory (ANL), Argonne, IL (United States)

Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22). Materials Sciences & Engineering Division; National Science Foundation (NSF); USDOE

Grant/Contract Number:: AC02-06CH11357; FG02-01ER45945

OSTI ID:: 1476649

Alternate ID(s):: OSTI ID: 1636149

Journal Information:: Surface Science Reports, Vol. 73, Issue 5; ISSN 0167-5729

Publisher:: ElsevierCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 25 works

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Upcycling Single-Use Polyethylene into High-Quality Liquid Products Celik, Gokhan; Kennedy, Robert M.; Hackler, Ryan A. ACS Central Science, Vol. 5, Issue 11 https://doi.org/10.1021/acscentsci.9b00722	journal	September 2019

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