Dear Users
I want to create a csv of all structures excluding the ionic crystals
I decide to use the simple algorithm based on electronegativity.
Is difference in the electronegativity of two bonding atoms is above 2.0 - the bond is ionic.
Can I obtain the electronegativity of the atoms using pymatgen?
Some complex structures have both covalent and ionic bonds. How do I classify these structures? Are they ionic structures?