{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8540711 -1.6451638 -5.4325609 ] [ -5.1836275 2.006214 5.7138226 ] [ -5.9196005 1.5827822 -1.7557937 ] [ 3.5140603 -0.8698087 -1.6500317 ] [ 5.8330446 -2.7277281 4.5871807 ] [ -0.5998186 -3.3580335 -3.1856244 ] [ 5.2100128 5.0117379 1.7230074 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.572726028194676e-09 -2.635842999462649e-09 -8.70392213676201e-09 ] [ -8.305086859859833e-09 3.214309193603675e-09 9.154553060541127e-09 ] [ -9.484245603714716e-09 2.535896657551115e-09 -2.813091640264405e-09 ] [ 5.63014530312703e-09 -1.393587175189916e-09 -2.643642235099298e-09 ] [ 9.345567763199875e-09 -4.370302225725215e-09 7.349473733475763e-09 ] [ -9.610153455585923e-10 -5.380162809889239e-09 -5.10393297838027e-09 ] [ 8.347360771000915e-09 8.029689359112227e-09 2.760562196489091e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.238048 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.242492762337043e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.277812 1.6432803 2.5529395 ] [ 2.0036909 3.2502639 4.5316675 ] [ 1.508957 4.0754318 2.2952698 ] [ 4.7868148 1.9001108 2.0926615 ] [ 4.02952 1.9058395 4.406453 ] [ 3.2290246 3.2410017 0.7878852 ] [ 3.9453858 4.1057771 3.0926387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.277812e-10 1.6432803e-10 2.5529395e-10 ] [ 2.0036909e-10 3.2502639e-10 4.5316675e-10 ] [ 1.508957e-10 4.0754318e-10 2.2952698e-10 ] [ 4.7868148e-10 1.9001108e-10 2.0926615e-10 ] [ 4.02952e-10 1.9058395e-10 4.406453e-10 ] [ 3.2290246e-10 3.2410017e-10 7.878851999999999e-11 ] [ 3.9453858e-10 4.1057771e-10 3.0926387e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.66e-05 -1.86e-05 -1.03e-05 ] [ -2.73e-05 -1.89e-05 3.59e-05 ] [ -6.12e-05 4.15e-05 9.9e-06 ] [ -7.86e-05 3.68e-05 6.76e-05 ] [ -3.33e-05 1.66e-05 -0.0001128 ] [ 1.5e-05 -6.48e-05 1.05e-05 ] [ 9.88e-05 7.5e-06 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.387484965044e-13 -2.98004853924e-14 -1.65024193302e-14 ] [ -4.37394221082e-14 -3.02811383826e-14 5.751814116059999e-14 ] [ -9.805321000079999e-14 6.649033031099999e-14 1.58615486766e-14 ] [ -1.259310834324e-13 5.896010013119999e-14 1.083071404584e-13 ] [ -5.33524819122e-14 2.65961321244e-14 -1.807255243152e-13 ] [ 2.403264951e-14 -1.038210458832e-13 1.6822854657e-14 ] [ 1.582950514392e-13 1.2016324755e-14 -1.4419589706e-15 ] ] } "relaxed-potential-energy" { "source-value" -26.557231 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.254937497194045e-18 } }