{ "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" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.095115 -3.6100142 -0.1677916 ] [ -0.1000103 0.1001899 -0.9027169 ] [ 0.8170433 -0.8278801 0.4601415 ] [ 0.7531078 -2.2906799 1.6145362 ] [ 2.6249743 6.6283843 -1.0041691 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.561097512487392e-09 -5.783880351996016e-09 -2.688317786866253e-10 ] [ -1.602341644991942e-10 1.605219154202899e-10 -1.446311912381052e-09 ] [ 1.309047673441281e-09 -1.326410141045566e-09 7.372279535598432e-10 ] [ 1.206611710102122e-09 -3.670073781516482e-09 2.586772153075273e-09 ] [ 4.205672453660845e-09 1.061984235913777e-08 -1.608856255349777e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.9739063992349486 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.764723305301746e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.5772279 1.5452624 0.4146868 ] [ 1.8097886 2.0404256 2.716411 ] [ 1.2266742 3.7477579 1.2041989 ] [ 3.7161102 1.5483993 1.4258152 ] [ 3.1329966 3.2557318 -0.0863962 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5772279e-10 1.5452624e-10 4.146868e-11 ] [ 1.8097886e-10 2.0404256e-10 2.716411e-10 ] [ 1.2266742e-10 3.7477579e-10 1.2041989e-10 ] [ 3.7161102e-10 1.5483993e-10 1.4258152e-10 ] [ 3.1329966e-10 3.2557318e-10 -8.63962e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -1.8e-06 4e-07 ] [ 1e-06 2.9e-06 -4.3e-06 ] [ 6.1e-06 -4.2e-06 2e-06 ] [ -7.7e-06 3.7e-06 -1.1e-06 ] [ -2.7e-06 -6e-07 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -2.88391791744e-15 6.408706483200001e-16 ] [ 1.6021766208e-15 4.646312200320001e-15 -6.889359469440001e-15 ] [ 9.77327738688e-15 -6.72914180736e-15 3.2043532416e-15 ] [ -1.233675998016e-14 5.928053496960001e-15 -1.76239428288e-15 ] [ -4.32587687616e-15 -9.6130597248e-16 4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }