{ "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" [ [ 2.61879 2.030613 1.31449 ] [ 0.5326459 2.599792 1.87087 ] [ 1.791863 1.569063 3.307142 ] [ 2.645053 4.244738 2.416375 ] [ 4.072939 1.030921 3.139936 ] [ 4.500349 3.153395 1.645552 ] [ 3.28786 3.426147 4.164789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.61879e-10 2.030613e-10 1.31449e-10 ] [ 5.326459000000001e-11 2.599792e-10 1.87087e-10 ] [ 1.791863e-10 1.569063e-10 3.307142e-10 ] [ 2.645053e-10 4.244738e-10 2.416375e-10 ] [ 4.072939e-10 1.030921e-10 3.139936e-10 ] [ 4.500349e-10 3.153395e-10 1.645552e-10 ] [ 3.28786e-10 3.426147e-10 4.164789e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8765266 -4.429705 -11.4112744 ] [ -6.6067698 3.6515158 -2.6687777 ] [ -1.419543 -3.8633295 8.9048467 ] [ -5.3711657 6.8960929 -7.2094557 ] [ 2.4967164 -1.0284915 1.0072853 ] [ 5.6307194 1.2515139 -0.4699608 ] [ 4.3935161 -2.4775966 11.8473365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.404350426029314e-09 -7.097169788040864e-09 -1.828287705721355e-08 ] [ -1.058521211256749e-08 5.850373245241809e-09 -4.275853237052397e-09 ] [ -2.274358606820294e-09 -6.189736203346954e-09 1.426713719454803e-08 ] [ -8.605556110982866e-09 1.104875881924487e-08 -1.15508213712333e-08 ] [ 4.000180644847941e-09 -1.647825035991523e-09 1.613848958135514e-09 ] [ 9.021406980965005e-09 2.005146311186229e-09 -7.529602064524647e-10 ] [ 7.039188778528396e-09 -3.96954734829357e-09 1.89815255590505e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.934285 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.591647917136413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6248544 1.3927178 1.0600092 ] [ 0.8479456 3.0313994 1.8393956 ] [ 1.6337441 1.3094689 3.5090466 ] [ 2.676614 4.5145917 2.477839 ] [ 4.2550988 1.4334762 3.140317 ] [ 4.3880241 3.1988629 1.3414302 ] [ 3.0232188 3.1741521 4.4911164 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6248544e-10 1.3927178e-10 1.0600092e-10 ] [ 8.479456e-11 3.0313994e-10 1.8393956e-10 ] [ 1.6337441e-10 1.3094689e-10 3.5090466e-10 ] [ 2.676614e-10 4.5145917e-10 2.477839e-10 ] [ 4.2550988e-10 1.4334762e-10 3.140317e-10 ] [ 4.3880241e-10 3.1988629e-10 1.3414302e-10 ] [ 3.0232188e-10 3.1741521e-10 4.4911164e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.14e-05 2.1e-05 3.1e-06 ] [ 2.2e-06 -2.79e-05 -1.17e-05 ] [ -1.26e-05 2.58e-05 -8e-07 ] [ -9.3e-06 1.26e-05 -1.2e-06 ] [ 2e-07 1.92e-05 -2.01e-05 ] [ -2e-06 -3.36e-05 -6.7e-06 ] [ 1e-05 -1.71e-05 3.74e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.826481347712e-14 3.36457090368e-14 4.96674752448e-15 ] [ 3.52478856576e-15 -4.470072772032e-14 -1.874546646336e-14 ] [ -2.018742542208e-14 4.133615681664e-14 -1.28174129664e-15 ] [ -1.490024257344e-14 2.018742542208e-14 -1.92261194496e-15 ] [ 3.2043532416e-16 3.076179111936e-14 -3.220375007808e-14 ] [ -3.2043532416e-15 -5.383313445888e-14 -1.073458335936e-14 ] [ 1.6021766208e-14 -2.739722021568e-14 5.992140561792e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.815392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.854340455278736e-18 } }