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#battchatt — Public Fediverse posts

Live and recent posts from across the Fediverse tagged #battchatt, aggregated by home.social.

  1. Dr. Angela Harper @[email protected] ·

    Nothing like starting the new year off with a publication!

    We present a #FirstPrinciples model of amorphous Al2O3 which reproduces the features of experimental 27Al #NMR and Al K-edge #XAS spectra on an #ALD -deposited sample of amorphous Al2O3.

    #article
    doi.org/10.1039/D2SC04035B

    #CompChem #OpenAccess #BattChatt #Spectroscopy

    #firstprinciples #nmr #xas #ald #compchem #openaccess
  2. Dr. Angela Harper @[email protected] ·

    Nothing like starting the new year off with a publication!

    We present a #FirstPrinciples model of amorphous Al2O3 which reproduces the features of experimental 27Al #NMR and Al K-edge #XAS spectra on an #ALD -deposited sample of amorphous Al2O3.

    #article
    doi.org/10.1039/D2SC04035B

    #CompChem #OpenAccess #BattChatt #Spectroscopy

    #article #firstprinciples #nmr #xas #ald #compchem