@article{articlea4ace990, title = {Ab initio investigation of the atomistic descriptors in the activation of small molecules on 3d transition-metal 13-atom clusters: The example of H2, CO, H2O, and CO2}, author = {Restrepo, Vivianne k and Besse, Larissa Zibordi and Silva, Juarez Lopes Ferreira da}, year = {2019}, doi = {10.1063/1.5125769}, journal = {The Journal of Chemical Physics} }