{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.8335591 -2.7912288 -1.564997 ] [ 1.8070522 0.7378379 -2.5332106 ] [ 9.5959385 -19.4178406 11.103334 ] [ 4.0024877 14.3290314 -19.5773484 ] [ -7.5719193 7.1422001 12.5722219 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.255074535107807e-08 -4.472041563507859e-09 -2.507401625680098e-09 ] [ 2.895216811258295e-09 1.182146643059628e-09 -4.05865083232112e-09 ] [ 1.537438844600101e-08 -3.111081049205654e-08 1.778950229429776e-08 ] [ 6.412692270812401e-09 2.29576392969323e-08 -3.136637016215728e-08 ] [ -1.213155217699363e-08 1.144306611557246e-08 2.014292016564308e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.9455096536311505 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.514873474269262e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9145349 0.4662409 0.2713478 ] [ 0.7271501 0.5349118 2.6068478 ] [ 2.8363692 0.1899982 1.6442118 ] [ 2.4868013 2.1925143 0.4771026 ] [ 1.2361105 2.7947467 2.3493422 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.145349e-11 4.662409000000001e-11 2.713478e-11 ] [ 7.271501000000001e-11 5.349118000000001e-11 2.6068478e-10 ] [ 2.8363692e-10 1.899982e-11 1.6442118e-10 ] [ 2.4868013e-10 2.1925143e-10 4.771026e-11 ] [ 1.2361105e-10 2.7947467e-10 2.3493422e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.33e-05 3.13e-05 9.76e-05 ] [ 9.55e-05 2.48e-05 -7.56e-05 ] [ -9.91e-05 -1.53e-05 -4.04e-05 ] [ -2.12e-05 -3.61e-05 4.81e-05 ] [ -3.85e-05 -4.7e-06 -2.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.014177809322e-13 5.014812864419999e-14 1.563724394784e-13 ] [ 1.53007868547e-13 3.97339805232e-14 -1.211245535304e-13 ] [ -1.587757044294e-13 -2.45133025002e-14 -6.472793601359999e-14 ] [ -3.39661446408e-14 -5.783857648740001e-14 7.706469609539999e-14 ] [ -6.168380040899999e-14 -7.530230179799999e-15 -4.75846460298e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.68810404636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.872640719885302e-18 } }