{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.3824175 -10.5733885 -5.8484518 ] [ -16.5405649 2.9312246 13.7499388 ] [ 3.1430581 5.4832758 -22.606332 ] [ 15.5180903 -12.7330425 9.3024724 ] [ 5.2618341 14.8919306 5.4023727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.182793672348478e-08 -1.694043585733558e-08 -9.370252741835679e-09 ] [ -2.650090637760509e-08 4.696339524433833e-09 2.202983048279081e-08 ] [ 5.035734205636069e-09 8.785176292158418e-09 -3.62193366124429e-08 ] [ 2.486272147812326e-08 -2.040058300515278e-08 1.490420379491726e-08 ] [ 8.43038757754821e-09 2.385950304589612e-08 8.655555236788172e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 4.7147059 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.553791566927823e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.7274309 0.752563 0.9501406 ] [ 1.9246612 2.5262116 2.5135902 ] [ 3.5926123 2.7512207 -0.271119 ] [ 4.8362784 1.0994838 2.2413024 ] [ 4.1749191 3.4987262 2.0390263 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7274309e-10 7.52563e-11 9.501406000000001e-11 ] [ 1.9246612e-10 2.5262116e-10 2.5135902e-10 ] [ 3.5926123e-10 2.7512207e-10 -2.71119e-11 ] [ 4.8362784e-10 1.0994838e-10 2.2413024e-10 ] [ 4.174919100000001e-10 3.4987262e-10 2.0390263e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.52e-05 7.9e-06 2.15e-05 ] [ 1.53e-05 9.3e-06 -1.65e-05 ] [ -2.16e-05 -2.4e-06 -2.49e-05 ] [ -2.89e-05 7.5e-06 -1.14e-05 ] [ 0.0 -2.23e-05 3.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.639661705216e-14 1.265719530432e-14 3.44467973472e-14 ] [ 2.451330229824e-14 1.490024257344e-14 -2.64359142432e-14 ] [ -3.460701500928e-14 -3.84522388992e-15 -3.989419785791999e-14 ] [ -4.630290434112001e-14 1.2016324656e-14 -1.826481347712e-14 ] [ 0.0 -3.572853864384e-14 4.998791056896e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.731874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719435762017138e-18 } }