{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9561271 0.2009027 2.827783 ] [ 0.6408175 2.004915 2.928704 ] [ 2.494403 2.793601 0.1007886 ] [ 2.213716 1.735143 2.110523 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.561271000000001e-11 2.009027e-11 2.827783e-10 ] [ 6.408175e-11 2.004915e-10 2.928704e-10 ] [ 2.494403e-10 2.793601e-10 1.007886e-11 ] [ 2.213716e-10 1.735143e-10 2.110523e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1422633 -23.1553543 1.3141278 ] [ -21.5695562 20.9833534 10.8501271 ] [ 0.1530719 -0.0697122 -0.1993447 ] [ 22.5587476 2.2417131 -11.9649102 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.830107554057857e-09 -3.709896730580075e-08 2.105464837903339e-09 ] [ -3.455823866467169e-08 3.361903824346419e-08 1.73838199723285e-08 ] [ 2.452482194814355e-10 -1.116912570245338e-10 -3.193854178203898e-10 ] [ 3.614309799924811e-08 3.591620319361093e-09 -1.916989939241145e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 2.4448971 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.91715697388172e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0000942 -0.0746264 2.6984358 ] [ 0.2638132 2.2167123 3.3761169 ] [ 2.6996522 2.6702504 -0.1234282 ] [ 2.3415041 1.9222255 2.0166741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0000942e-10 -7.46264e-12 2.6984358e-10 ] [ 2.638132e-11 2.2167123e-10 3.3761169e-10 ] [ 2.6996522e-10 2.6702504e-10 -1.234282e-11 ] [ 2.3415041e-10 1.9222255e-10 2.0166741e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9e-07 4e-06 5.6e-06 ] [ 6.4e-06 1.3e-06 -1.47e-05 ] [ -8e-06 6e-06 9.6e-06 ] [ 7e-07 -1.13e-05 -5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.44195895872e-15 6.4087064832e-15 8.972189076479999e-15 ] [ 1.025393037312e-14 2.08282960704e-15 -2.355199632576e-14 ] [ -1.28174129664e-14 9.6130597248e-15 1.538089555968e-14 ] [ 1.12152363456e-15 -1.810459581504e-14 -8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -7.474651 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.197571108083934e-18 } }