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Updated: Jan 30, 2026

Enhancement Method of Surface Acoustic Wave-Atomizer Efficiency for Olfactory Display
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Extent of Spin Contamination Errors in DFT/Plane-wave Calculation of Surfaces: A Case of Au Atom Aggregation on a MgO

Kohei Tada1, Tomohiro Maruyama2, Hiroaki Koga3

  • 1Research Institute of Electrochemical Energy, National Institute of Advanced Industrial Science and Technology (AIST), 1-8-31, Midorigaoka, Ikeda, Osaka 563-8577, Japan. k-tada@aist.go.jp.

Molecules (Basel, Switzerland)
|February 2, 2019
PubMed

Keywords:
Au clusterdimerizationgold catalystmolecule/surface interaction.open-shell structurespin contamination errorstatic electronic correlation

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