Comprehensive Phase Diagrams of MoS 2 Edge Sites Using Dispersion-Corrected DFT Free Energy Calculations

Andrew S. Rosen, Justin M. Notestein, Randall Q. Snurr

Research output: Contribution to journalArticle

7 Citations (Scopus)
Original languageEnglish (US)
Pages (from-to)15318-15329
Number of pages12
JournalJournal of Physical Chemistry C
Volume122
Issue number27
DOIs
StatePublished - 2018

Cite this

Comprehensive Phase Diagrams of MoS 2 Edge Sites Using Dispersion-Corrected DFT Free Energy Calculations. / Rosen, Andrew S.; Notestein, Justin M.; Snurr, Randall Q.

In: Journal of Physical Chemistry C, Vol. 122, No. 27, 2018, p. 15318-15329.

Research output: Contribution to journalArticle

Rosen, Andrew S. ; Notestein, Justin M. ; Snurr, Randall Q. / Comprehensive Phase Diagrams of MoS 2 Edge Sites Using Dispersion-Corrected DFT Free Energy Calculations. In: Journal of Physical Chemistry C. 2018 ; Vol. 122, No. 27. pp. 15318-15329.
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