%0 Journal Article %1 mcc17a %A McConnell, Sean %A Kästner, Johannes %D 2017 %J J. Comput. Chem. %K reaction instanton software theory, tunneling, update reactivity, theoretische stuttgart chemistry, chemie low-temperature kaestner from:alexanderdenzel kästner computational atom theochem rate, %P 2570–2580 %R 10.1002/jcc.24914 %T Instanton rate constant calculations close to and above the crossover temperature %U http://dx.doi.org/10.1002/jcc.24914 %V 38

@article{mcc17a, added-at = {2019-02-14T10:47:12.000+0100}, author = {McConnell, Sean and K\"astner, Johannes}, biburl = {https://puma.ub.uni-stuttgart.de/bibtex/2d0e671d9bcf5f3d799ed2b8911e3a56a/theochem}, doi = {10.1002/jcc.24914}, file = {:mcc17a.pdf:PDF}, interhash = {5fa872b74a66914552e738d8ccb0e4c3}, intrahash = {d0e671d9bcf5f3d799ed2b8911e3a56a}, journal = {J. Comput. Chem.}, keywords = {reaction instanton software theory, tunneling, update reactivity, theoretische stuttgart chemistry, chemie low-temperature kaestner from:alexanderdenzel kästner computational atom theochem rate,}, pages = {2570–2580}, timestamp = {2019-02-14T09:47:12.000+0100}, title = {Instanton rate constant calculations close to and above the crossover temperature}, url = {http://dx.doi.org/10.1002/jcc.24914}, volume = 38, year = 2017 }