Be_00

• Functional : GGA X Becke C Lee/Yang/Parr
• orbitals : sp (Mulliken dipole)
• Autor : Daniel.G.Trabada
• method : charge_Bes190480p000380 automatic generation
• cristal = fcc
• E_min = -27.45
• a_min = 3.151 angs
• Bulk modulus = 123 GPa
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