{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1475332 -9.177114 -7.3922867 ] [ -11.3960651 6.7038656 3.7268343 ] [ -3.3113153 -5.9140739 8.126805 ] [ 1.2230287 2.6102452 -6.8347527 ] [ 2.5088547 2.295746 4.068851 ] [ 7.303079 -3.9680851 -3.3292296 ] [ 3.5248848 7.4494163 1.6337786 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.363742438318106e-10 -1.470335749721637e-08 -1.184374892499078e-08 ] [ -1.825850907233481e-08 1.074077673330537e-08 5.971046785055533e-09 ] [ -5.305311957757338e-09 -9.475390936263477e-09 1.302057697280054e-08 ] [ 1.959507989707417e-09 4.18207383399542e-09 -1.095048098488968e-08 ] [ 4.019628345324198e-09 3.678190568495117e-09 6.519017945718701e-09 ] [ 1.170082243365544e-08 -6.35757317656483e-09 -5.334013830395336e-09 ] [ 5.647488017573284e-09 1.193528063446644e-08 2.617601876483355e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.924493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.070732052029325e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4193214 1.0884887 2.2271483 ] [ 1.2480721 3.366952 2.9969376 ] [ 2.16519 1.7149004 4.634301 ] [ 3.3292165 3.4338264 1.3176046 ] [ 4.3307627 2.8178074 4.6648076 ] [ 4.799792 1.799558 2.5083717 ] [ 3.3170632 4.6839501 3.4828752 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4193214e-10 1.0884887e-10 2.2271483e-10 ] [ 1.2480721e-10 3.366952e-10 2.9969376e-10 ] [ 2.16519e-10 1.7149004e-10 4.634301e-10 ] [ 3.3292165e-10 3.4338264e-10 1.3176046e-10 ] [ 4.3307627e-10 2.8178074e-10 4.6648076e-10 ] [ 4.799792e-10 1.799558e-10 2.5083717e-10 ] [ 3.3170632e-10 4.6839501e-10 3.4828752e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 1.53e-05 6.1e-06 ] [ 1.1e-06 -4e-06 -1.38e-05 ] [ 9.2e-06 -5.7e-06 -1.5e-06 ] [ -8.4e-06 -6.8e-06 1.18e-05 ] [ -6.8e-06 -2e-07 -6.5e-06 ] [ 1.3e-06 2.3e-06 3.5e-06 ] [ 7.4e-06 -1e-06 5e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 2.451330229824e-14 9.77327738688e-15 ] [ 1.76239428288e-15 -6.4087064832e-15 -2.211003736704e-14 ] [ 1.474002491136e-14 -9.13240673856e-15 -2.4032649312e-15 ] [ -1.345828361472e-14 -1.089480102144e-14 1.890568412544e-14 ] [ -1.089480102144e-14 -3.2043532416e-16 -1.04141480352e-14 ] [ 2.08282960704e-15 3.68500622784e-15 5.6076181728e-15 ] [ 1.185610699392e-14 -1.6021766208e-15 8.010883104e-16 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }