{ "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" [ [ -6.4108371 2.5452315 2.2976118 ] [ 2.4067587 -3.0531194 0.7599513 ] [ -0.1982626 3.714049 -2.5896848 ] [ 6.0849279 -2.9444375 -2.1644733 ] [ 1.5245632 3.0947958 -1.3205988 ] [ -3.9520244 -1.186213 -1.9419956 ] [ 0.5448742 -2.1703065 4.9591894 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.027129332137727e-08 4.077910403823715e-09 3.681179909634205e-09 ] [ 3.856052521047001e-09 -4.891636523190923e-09 1.217576205806567e-09 ] [ -3.176517024990221e-10 5.95056247630562e-09 -4.149132441801124e-09 ] [ 9.749129220633642e-09 -4.7175089239068e-09 -3.467868517605825e-09 ] [ 2.442619515972035e-09 4.958409476910033e-09 -2.115832522816535e-09 ] [ -6.331841098511148e-09 -1.90052273588903e-09 -3.111419948016469e-09 ] [ 8.729847045171033e-10 -3.477214334270276e-09 7.94549731479918e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.206573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.756796898468852e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5658919 2.3814496 3.5603001 ] [ 1.7464992 4.5902262 3.1789395 ] [ 2.8939322 3.5680468 1.3529934 ] [ 4.7757969 2.2537264 2.3731029 ] [ 4.5905872 2.6965196 4.8258226 ] [ 5.0989361 4.5352073 1.4053119 ] [ 6.1022754 4.0334721 3.5269445 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5658919e-10 2.3814496e-10 3.5603001e-10 ] [ 1.7464992e-10 4.5902262e-10 3.1789395e-10 ] [ 2.8939322e-10 3.5680468e-10 1.3529934e-10 ] [ 4.7757969e-10 2.2537264e-10 2.3731029e-10 ] [ 4.5905872e-10 2.6965196e-10 4.8258226e-10 ] [ 5.0989361e-10 4.5352073e-10 1.4053119e-10 ] [ 6.1022754e-10 4.0334721e-10 3.5269445e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.16e-05 6.23e-05 3.69e-05 ] [ -1.67e-05 -2.16e-05 -2.33e-05 ] [ -1.52e-05 -3.72e-05 -3.36e-05 ] [ -5.48e-05 4.56e-05 -7e-06 ] [ 9.4e-06 -5.58e-05 7.5e-06 ] [ 4.79e-05 -4.8e-06 6.25e-05 ] [ -2.22e-05 1.14e-05 -4.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.267231363328e-14 9.981560347584e-14 5.912031730752001e-14 ] [ -2.675634956736e-14 -3.460701500928e-14 -3.733071526464e-14 ] [ -2.435308463616e-14 -5.960097029376001e-14 -5.383313445888e-14 ] [ -8.779927881984e-14 7.305925390848e-14 -1.12152363456e-14 ] [ 1.506046023552e-14 -8.940145544064e-14 1.2016324656e-14 ] [ 7.674426013632e-14 -7.69044777984e-15 1.001360388e-13 ] [ -3.556832098176e-14 1.826481347712e-14 -6.873337703232e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.015181 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.367003168008036e-18 } }