The Journal of Chemical Physics
@jchemphys
The MOST CITED journal in chemical physics publishing cutting edge research in all areas of modern #chemicalphysics and #physicalchemistry at @AIP_Publishing
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https://pubs.aip.org/aip/jcp 09-03-2022 17:43:52
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Calculating electronic coupling matrix elements from Density Functional Theory allows for an accurate and insightful description of adsorbed systems within the popular Newns-Anderson model. Fritz Haber Institute of the Max Planck Society Universität Bayreuth aippub.org/48RTxyU