{ "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" [ [ 3.034718 3.53714 2.04977 ] [ 2.090115 3.249613 4.258758 ] [ 4.260617 1.92046 3.281861 ] [ 5.152468 4.155846 3.194292 ] [ 3.505339 5.178097 3.977293 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.034718e-10 3.53714e-10 2.04977e-10 ] [ 2.090115e-10 3.249613e-10 4.258758e-10 ] [ 4.260617e-10 1.92046e-10 3.281861e-10 ] [ 5.152468e-10 4.155846e-10 3.194292e-10 ] [ 3.505339e-10 5.178097e-10 3.977293e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.2441259 -9.0726904 13.5033093 ] [ 7.1876503 6.7690859 -8.0016011 ] [ -3.7844251 13.813173 -6.5018998 ] [ -0.8773092 -6.7283361 -0.5887129 ] [ -5.7700418 -4.7812324 1.5889045 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.197662671911759e-09 -1.45360524466366e-08 2.163468646389122e-08 ] [ 1.151588526914611e-08 1.084527117316693e-08 -1.281997821138756e-08 ] [ -6.063317418388702e-09 2.21311428396658e-08 -1.04171918503442e-08 ] [ -1.405604289452751e-09 -1.077998279630465e-08 -9.432220447433683e-10 ] [ -9.24462607299875e-09 -7.660378769891475e-09 2.545705642583914e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.8442878 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.761404657586667e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4837678 2.3532989 2.5194234 ] [ 1.8292121 4.0804962 3.7328426 ] [ 4.6928654 2.3603653 2.457135 ] [ 5.4036161 4.0919523 3.6320743 ] [ 3.6337956 5.1550433 4.4204987 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4837678e-10 2.3532989e-10 2.5194234e-10 ] [ 1.8292121e-10 4.0804962e-10 3.7328426e-10 ] [ 4.692865399999999e-10 2.3603653e-10 2.457135e-10 ] [ 5.4036161e-10 4.0919523e-10 3.6320743e-10 ] [ 3.6337956e-10 5.1550433e-10 4.4204987e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.2e-06 -6.22e-05 -4.33e-05 ] [ 3.03e-05 5.18e-05 3.53e-05 ] [ -1.19e-05 5.8e-06 4.8e-06 ] [ 4.61e-05 -8.5e-06 -7.4e-06 ] [ -5.83e-05 1.31e-05 1.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.93349504896e-15 -9.965538581376e-14 -6.937424768064e-14 ] [ 4.854595161024e-14 8.299274895744e-14 5.655683471424e-14 ] [ -1.906590178752e-14 9.292624400640001e-15 7.69044777984e-15 ] [ 7.386034221888001e-14 -1.36185012768e-14 -1.185610699392e-14 ] [ -9.340689699264e-14 2.098851373248e-14 1.714328984256e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.370748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.821794660660836e-18 } }