{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1992178 -3.4451809 -2.7099006 ] [ -14.8432737 3.0022034 -2.2384446 ] [ 1.7297541 -3.0388207 -0.2435902 ] [ 8.1720436 10.8284406 -8.3503102 ] [ 4.7422581 -7.3466424 13.5422457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.191821042368851e-10 -5.51978833788309e-09 -4.34173942178258e-09 ] [ -2.378154629420672e-08 4.810060137995354e-09 -3.586383634623476e-09 ] [ 2.771371601585699e-09 -4.868727520455524e-09 -3.902745267113868e-10 ] [ 1.309305730794924e-08 1.734907451197694e-08 -1.337867188909186e-08 ] [ 7.597935120217234e-09 -1.177061879163368e-08 2.169706963242697e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1650421 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.147966303424629e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4719085 2.1490688 1.2364099 ] [ 3.2097119 3.9716788 2.902239 ] [ 5.0588684 1.0152193 2.9320428 ] [ 4.3800357 5.8644151 2.0097452 ] [ 4.7186055 2.9627131 4.596598 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4719085e-10 2.1490688e-10 1.2364099e-10 ] [ 3.2097119e-10 3.9716788e-10 2.902239e-10 ] [ 5.0588684e-10 1.0152193e-10 2.9320428e-10 ] [ 4.3800357e-10 5.864415100000001e-10 2.0097452e-10 ] [ 4.7186055e-10 2.9627131e-10 4.596598e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.1e-06 3.41e-05 1.41e-05 ] [ -1.56e-05 -3.67e-05 2.04e-05 ] [ 8.4e-06 7.3e-06 1.19e-05 ] [ 1.55e-05 1.18e-05 -2.79e-05 ] [ -1.04e-05 -1.64e-05 -1.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.364570931399999e-15 5.46342232194e-14 2.25906905394e-14 ] [ -2.49939554904e-14 -5.879988246779999e-14 3.26844033336e-14 ] [ 1.34582837256e-14 1.16958894282e-14 1.90659019446e-14 ] [ 2.4833737827e-14 1.89056842812e-14 -4.470072808859999e-14 ] [ -1.66626369936e-14 -2.62756967976e-14 -2.94800500656e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196954159838e-18 } }