{ "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" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.2203639 -1.167767 6.3337801 ] [ -0.1367333 0.3901451 0.263958 ] [ -4.2255986 3.2300398 -6.3126593 ] [ 6.0563374 -7.492453 -4.8856943 ] [ 2.3562105 -1.3000203 4.8246635 ] [ 0.6385422 3.3468427 -4.7088723 ] [ 3.5316057 2.9932127 4.4848243 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.317047485504831e-08 -1.870968985941754e-09 1.014783439750829e-08 ] [ -2.190708965448326e-10 6.250813579396781e-10 4.229073364731265e-10 ] [ -6.77015528580521e-09 5.175094251813509e-09 -1.011399514553569e-08 ] [ 9.703322189956657e-09 -1.200423302904282e-08 -7.827745183835821e-09 ] [ 3.775065376783479e-09 -2.082862131225402e-09 7.7299630629271e-09 ] [ 1.023057384234198e-09 5.362233127435148e-09 -7.544445109392724e-09 ] [ 5.658256086424019e-09 4.795655409021644e-09 7.185480641855725e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.260957 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.483768879163411e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5561885 3.1912272 4.7527421 ] [ 1.6993673 4.0314086 2.7237658 ] [ 3.4203212 3.5810291 1.1772885 ] [ 4.2866387 1.5414855 1.9694669 ] [ 4.6733565 2.3523177 4.1445098 ] [ 5.1406322 5.1006719 1.7133252 ] [ 5.9974146 4.2605081 3.7423166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5561885e-10 3.191227200000001e-10 4.7527421e-10 ] [ 1.6993673e-10 4.0314086e-10 2.7237658e-10 ] [ 3.4203212e-10 3.5810291e-10 1.1772885e-10 ] [ 4.2866387e-10 1.5414855e-10 1.9694669e-10 ] [ 4.6733565e-10 2.3523177e-10 4.1445098e-10 ] [ 5.1406322e-10 5.100671900000001e-10 1.7133252e-10 ] [ 5.9974146e-10 4.2605081e-10 3.7423166e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.39e-05 -1.88e-05 -2.71e-05 ] [ 2.22e-05 5e-07 -2.7e-06 ] [ -7e-06 4.7e-05 1.96e-05 ] [ 3.06e-05 -1.7e-05 1.57e-05 ] [ -7.03e-05 -1.34e-05 2.32e-05 ] [ -5.51e-05 -1.6e-06 -4.9e-05 ] [ 6.58e-05 3.3e-06 2.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.227025502912e-14 -3.012092047104e-14 -4.341898642368e-14 ] [ 3.556832098176e-14 8.010883104e-16 -4.32587687616e-15 ] [ -1.12152363456e-14 7.530230117759999e-14 3.140266176767999e-14 ] [ 4.902660459647999e-14 -2.72370025536e-14 2.515417294656e-14 ] [ -1.1263301644224e-13 -2.146916671872e-14 3.717049760256e-14 ] [ -8.827993180608e-14 -2.56348259328e-15 -7.85066544192e-14 ] [ 1.0542322164864e-13 5.28718284864e-15 3.252418540224e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.12274 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.743365371203699e-18 } }