@inproceedings{pernot:hal-04062441, TITLE = {{Prediction uncertainty validation for computational chemists}}, AUTHOR = {Pernot, Pascal}, URL = {https://universite-paris-saclay.hal.science/hal-04062441}, BOOKTITLE = {{Error control in first-principles modelling (CECAM Flagship workshop)}}, ADDRESS = {Lausanne, Switzerland}, ORGANIZATION = {{Gabor Csanyi and Genevieve Dusson and Michael Herbst and Youssef Marzouk}}, HAL_LOCAL_REFERENCE = {ICPO\_THEOSIM}, YEAR = {2022}, MONTH = Jun, HAL_ID = {hal-04062441}, HAL_VERSION = {v1}, }