Pascal Henkel, Doreen Mollenhauer. Uncertainty of exchange-correlation functionals in density functional theory calculations for lithium-based solid electrolytes on the case study of lithium phosphorus oxynitride. Journal of Computational Chemistry, 42(18):1283-1295, 2021. [doi]
@article{HenkelM21, title = {Uncertainty of exchange-correlation functionals in density functional theory calculations for lithium-based solid electrolytes on the case study of lithium phosphorus oxynitride}, author = {Pascal Henkel and Doreen Mollenhauer}, year = {2021}, doi = {10.1002/jcc.26546}, url = {https://doi.org/10.1002/jcc.26546}, researchr = {https://researchr.org/publication/HenkelM21}, cites = {0}, citedby = {0}, journal = {Journal of Computational Chemistry}, volume = {42}, number = {18}, pages = {1283-1295}, }