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Karsten Reuter

Fritz Haber Institute of the Max Planck SocietyORCID https://orcid.org/0000-0001-8473-8659

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Top Publications

Ab initio molecular simulations with numeric atom-centered orbitals

Computer Physics Communications20092,856 citations

Composition, structure, and stability of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:msub><mml:mrow><mml:mi mathvariant="normal">RuO</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub></mml:mrow><mml:mn/><mml:mo>(</mml:mo><mml:mn>110</mml:mn><mml:mo>)</mml:mo><mml:mn/></mml:math>as a function of oxygen pressure

Physical review. B, Condensed matter20012,052 citationsFirst authorCorresponding

Resolution-of-identity approach to Hartree–Fock, hybrid density functionals, RPA, MP2 and<i>GW</i>with numeric atom-centered orbital basis functions

New Journal of Physics2012711 citations

Karsten Reuter · Scinovex