{ "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" [ [ 2.176849 1.681974 3.211274 ] [ 2.864727 5.809081 2.248654 ] [ 2.905691 3.612446 1.71083 ] [ 4.50356 2.090932 1.710731 ] [ 5.648677 2.904188 3.876429 ] [ 4.83518 4.522991 2.188517 ] [ 3.438619 4.083879 4.381538 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.176849e-10 1.681974e-10 3.211274e-10 ] [ 2.864727e-10 5.809081e-10 2.248654e-10 ] [ 2.905691e-10 3.612446e-10 1.71083e-10 ] [ 4.503560000000001e-10 2.090932e-10 1.710731e-10 ] [ 5.648677e-10 2.904188e-10 3.876429e-10 ] [ 4.835180000000001e-10 4.522991000000001e-10 2.188517e-10 ] [ 3.438619e-10 4.083879e-10 4.381538e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0987944 0.382571 1.0676003 ] [ -3.3697155 6.9836621 0.6055726 ] [ -10.310075 -4.0465921 -6.3425417 ] [ 3.1494816 -7.0610551 -1.49441 ] [ 1.4339496 -1.2934453 2.0537184 ] [ 10.9223197 6.3186335 -2.0648608 ] [ -1.7271659 -1.2837742 6.1749212 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.582860779459635e-10 6.129463119960768e-10 1.710484241019066e-09 ] [ -5.398879392847382e-09 1.118906014418703e-08 9.7023426191707e-10 ] [ -1.651856112369456e-08 -6.483355256533976e-09 -1.016187202818909e-08 ] [ 5.046025787159777e-09 -1.131305739940061e-08 -2.394308763889728e-09 ] [ 2.297440524525512e-09 -2.072327819943642e-09 3.290419606186783e-09 ] [ 1.749948526824327e-08 1.012356686910368e-08 -3.308271698966385e-09 ] [ -2.767224825222991e-09 -2.056833009626224e-09 9.893314381922281e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5614088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.531906564127139e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1596985 2.0085194 3.3960907 ] [ 3.1024666 5.2951002 2.5095421 ] [ 2.4777387 3.384267 1.2046934 ] [ 4.326851 1.749027 1.9705568 ] [ 5.4887046 3.1848653 3.4978672 ] [ 5.48926 5.259347 2.2981791 ] [ 3.3285837 3.8243651 4.4510437 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1596985e-10 2.0085194e-10 3.3960907e-10 ] [ 3.1024666e-10 5.295100200000001e-10 2.5095421e-10 ] [ 2.4777387e-10 3.384267e-10 1.2046934e-10 ] [ 4.326851e-10 1.749027e-10 1.9705568e-10 ] [ 5.488704600000001e-10 3.1848653e-10 3.4978672e-10 ] [ 5.48926e-10 5.259347e-10 2.2981791e-10 ] [ 3.3285837e-10 3.8243651e-10 4.4510437e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.8e-06 8.4e-06 -2.6e-06 ] [ 8.2e-06 9.6e-06 3.1e-06 ] [ 2.1e-06 -1.72e-05 6.1e-06 ] [ 2.5e-06 -2.4e-06 -2.9e-06 ] [ -1.68e-05 -1.35e-05 -2.9e-06 ] [ -1.03e-05 1.02e-05 7.5e-06 ] [ 9.5e-06 5e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.69044777984e-15 1.345828361472e-14 -4.16565921408e-15 ] [ 1.313784829056e-14 1.538089555968e-14 4.96674752448e-15 ] [ 3.36457090368e-15 -2.755743787776e-14 9.77327738688e-15 ] [ 4.005441552e-15 -3.84522388992e-15 -4.646312200320001e-15 ] [ -2.691656722944e-14 -2.16293843808e-14 -4.646312200320001e-15 ] [ -1.650241919424e-14 1.634220153216e-14 1.2016324656e-14 ] [ 1.52206778976e-14 8.010883104e-15 -1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }