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Thinking specifically for tensor properties, could probably use a common tensor implementation (eg from pymatgen.core.tensor). There are some edges of the diagram that don't make sense/aren't practicable to implement right now.
The text was updated successfully, but these errors were encountered:
Basically the equations here: https://en.wikipedia.org/wiki/Constitutive_equation (specifically mechanical, thermoelectric and electromagnetic properties). These are basic enough that I think they should be required prior to any v1 of propnet.
e.g. applied_stress + elastic_tensor + lattice --> strained lattice etc.
see also https://static.cambridge.org/content/id/urn%3Acambridge.org%3Aid%3Aarticle%3AS215968591600029X/resource/name/S215968591600029X_figAb.jpeg?pub-status=live
Thinking specifically for tensor properties, could probably use a common tensor implementation (eg from pymatgen.core.tensor). There are some edges of the diagram that don't make sense/aren't practicable to implement right now.
The text was updated successfully, but these errors were encountered: