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The above script returned the entry of mp-546794 with energy_above_hull = 0.0. However, using mpr.summary.search
or referring to the web site of mp-546794 shows the energy_above_hull of mp-546794 is 0.005647450555557043 or 0.006.
The text was updated successfully, but these errors were encountered:
-------------script starts-------------------
from mp_api.client import MPRester
mpr = MPRester("32-digit API key")
entries = mpr.get_entries("mp-546794", inc_structure=None,
property_data=["material_id", "composition", "energy_above_hull"], #sort_by_e_above_hull=True,
additional_criteria={"thermo_types": ["GGA_GGA+U"]})
-------------script ends-------------------
The above script returned the entry of mp-546794 with energy_above_hull = 0.0. However, using mpr.summary.search
or referring to the web site of mp-546794 shows the energy_above_hull of mp-546794 is 0.005647450555557043 or 0.006.
The text was updated successfully, but these errors were encountered: