{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7456471 -3.8521549 -1.600863 ] [ -2.9417686 1.6730658 3.3967108 ] [ 0.112365 3.0935648 -1.7091697 ] [ 0.5172782 1.4386861 -0.5219239 ] [ 1.4228435 -3.0736233 0.9242417 ] [ 0.4393681 -1.2573957 -1.2539417 ] [ -0.2957332 1.9778571 0.7649457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.19465835098732e-09 -6.171832520480162e-09 -2.56486527170375e-09 ] [ -4.713232874723547e-09 2.680546909820049e-09 5.442130631378865e-09 ] [ 1.80028575996192e-10 4.956437197489828e-09 -2.738391734319749e-09 ] [ 8.287710384895066e-10 2.305029234089931e-09 -8.362142704167572e-10 ] [ 2.279646590757245e-09 -4.924487392406144e-09 1.480798443708448e-09 ] [ 7.039452977453165e-10 -2.014569993634451e-09 -2.009036075586207e-09 ] [ -4.738168190343706e-10 3.168876404903288e-09 1.225578116721491e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.451797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.436956762754758e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6139336 1.3685118 2.4587511 ] [ 1.7268666 2.855313 4.3266427 ] [ 2.3928737 3.9121486 2.0654001 ] [ 4.8478276 2.6604917 2.3396457 ] [ 3.9846839 1.7041668 4.5788644 ] [ 4.5731985 5.1382032 2.1249308 ] [ 3.883306 4.2771119 4.3706262 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6139336e-10 1.3685118e-10 2.4587511e-10 ] [ 1.7268666e-10 2.855313e-10 4.3266427e-10 ] [ 2.3928737e-10 3.9121486e-10 2.0654001e-10 ] [ 4.847827599999999e-10 2.6604917e-10 2.3396457e-10 ] [ 3.9846839e-10 1.7041668e-10 4.5788644e-10 ] [ 4.5731985e-10 5.138203200000001e-10 2.1249308e-10 ] [ 3.883306e-10 4.2771119e-10 4.3706262e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.2e-06 -1.6e-05 -1.4e-05 ] [ -2.16e-05 1.14e-05 1.3e-05 ] [ 1.7e-05 2.4e-06 9.2e-06 ] [ -3.6e-06 2.36e-05 -6.5e-06 ] [ 6.5e-06 -5.1e-06 9.7e-06 ] [ -5.9e-06 -1.75e-05 1.27e-05 ] [ 5.4e-06 1.2e-06 -2.42e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.52478856576e-15 -2.56348259328e-14 -2.24304726912e-14 ] [ -3.460701500928e-14 1.826481347712e-14 2.08282960704e-14 ] [ 2.72370025536e-14 3.84522388992e-15 1.474002491136e-14 ] [ -5.76783583488e-15 3.781136825088e-14 -1.04141480352e-14 ] [ 1.04141480352e-14 -8.17110076608e-15 1.554111322176e-14 ] [ -9.45284206272e-15 -2.8038090864e-14 2.034764308416e-14 ] [ 8.65175375232e-15 1.92261194496e-15 -3.877267422336e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }