6 results on '"Hättig, Christof"'
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2. A combined experimental and computational study on the adsorption and reactions of NO on rutile TiO2
3. Benchmarks for 0–0 transitions of aromatic organic molecules: DFT/B3LYP, ADC(2), CC2, SOS-CC2 and SCS-CC2 compared to high-resolution gas-phase data
4. Calculation of two-photon absorption strengths with the approximate coupled cluster singles and doubles model CC2 using the resolution-of-identity approximation
5. Quintuple-ζ quality coupled-cluster correlation energies with triple-ζ basis sets
6. Optimization of auxiliary basis sets for RI-MP2 and RI-CC2 calculations: Core–valence and quintuple-ζ basis sets for H to Ar and QZVPP basis sets for Li to Kr
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