Model Extended KIM ID = === Verification check vc-unit-conversion start (2021-08-05 18:52:02) === !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!! !!!!! !!!!! VERIFICATION CHECK: vc-unit-conversion !!!!! !!!!! !!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! !!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!!! Description: This verification check ensures that a model can properly convert units of length and energy. Working in one unit system, a random cluster of atoms is generated based on the smallest cutoff of the model such that the energy and/or forces (depending on what the model actually reports) are sizeable. Next, the model is reinitialized with a different set of registered units. The coordinates of the atoms in the cluster are rescaled to correspond to the new length units and the energy and/or forces are requested from the model once again. The energy and/or force returned by the model are then compared to a manual conversion of those originally returned (in the first set of units). Author: Daniel S. Karls Checking if model properly converts its cutoffs from Angstrom to Bohr ERROR: Requested units not accepted in kimpy.model.create. This means that the Model does not support unit conversion at all.. ERROR: Unable to perform verification check. Message = ERROR: Requested units not accepted in kimpy.model.create. This means that the Model does not support unit conversion at all.. === Verification check vc-unit-conversion end (2021-08-05 18:52:02) === Potential info: W potential Atomic number: 74 Potential info: W potential Atomic number: 74