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Generalized trajectory surface-hopping method for internal conversion and intersystem crossing
Download from aip.scitation.orgReactivity of Metal Catalysts in Glucose-Fructose Conversion
Download from pubman.mpdl.mpg.deCorrelated Ab Initio and Density Functional Studies on H2Activation by FeO+
Download from pubman.mpdl.mpg.deBis- and Tris(pyrazolyl)borate/Methane-Stabilized PIII-Centered Cations
Download from pubman.mpdl.mpg.deQuantum Mechanics/Molecular Mechanics Study of Oxygen Binding in Hemocyanin
Download from pubman.mpdl.mpg.deRole of Two Alternate Water Networks in Compound I Formation in P450eryF
Download from pubman.mpdl.mpg.deComputational Modeling of Photoexcitation in DNA Single and Double Strands
Download from ir.qibebt.ac.cnEnhanced E → Z Photoisomerisation in 2-Aminoazobenzene
Download from doi.orgNonequilibrium H/D Isotope Effects from Trajectory-Based Nonadiabatic Dynamics
Download from pubman.mpdl.mpg.deTheoretical rotation-vibration spectrum of thioformaldehyde
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