http://arxiv.org/abs/1502.03781
We hypothesize that in a non-metallic crystalline structure under extreme pressures, atomic wavefunctions deform to adopt a reduced rotational symmetry consistent with minimizing interstitial space in the crystal. We exemplify with a simple numeric variational calculation that yields the energy cost of this deformation for Helium to 25%. Balancing this with the free energy gained by tighter packing we obtain the pressures required to effect such deformation. The consequent modification of the structure suggests a decrease in the resistance to tangential stress, and an associated decrease of the crystal’s shear modulus. The atomic form factor is also modified. We also compare with neutron matter in the interior of compact stars.
P. Portela and F. Llanes-Estrada
Fri, 13 Feb 15
27/63
Comments: 6 pages, 13 figure files