{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.617948 3.024291 1.012928 ] [ 1.30973 1.622672 3.703727 ] [ 2.879916 3.04735 3.836046 ] [ 0.9226834 3.798669 3.025472 ] [ 3.183378 1.61886 2.358361 ] [ 3.567629 4.016165 2.010815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.617948e-10 3.024291e-10 1.012928e-10 ] [ 1.30973e-10 1.622672e-10 3.703727e-10 ] [ 2.879916000000001e-10 3.04735e-10 3.836046e-10 ] [ 9.226834e-11 3.798669e-10 3.025472e-10 ] [ 3.183378e-10 1.61886e-10 2.358361e-10 ] [ 3.567629e-10 4.016165e-10 2.010815e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4069445 -0.2637368 -0.7402386 ] [ -2.1820315 -1.9838411 0.2214473 ] [ 1.9736174 3.0787879 4.9203262 ] [ -1.5216831 1.2535455 0.1562714 ] [ 1.1215001 -2.573104 -3.1279041 ] [ 0.2016526 0.4883486 -1.4299021 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.519969638631456e-10 -4.225529350046054e-10 -1.185992978733723e-09 ] [ -3.495999855149155e-09 -3.178463829802155e-09 3.547976867992839e-10 ] [ 3.162083656684082e-09 4.932761993781928e-09 7.883231604349706e-09 ] [ -2.438005087086469e-09 2.008401293209046e-09 2.503743835796852e-10 ] [ 1.796841240444862e-09 -4.122567071686963e-09 -5.011454821124465e-09 ] [ 3.230830812435341e-10 7.824207097204109e-10 -2.290955714652824e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.789886 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.529818619429723e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7485715 3.3442317 0.97083 ] [ 1.713841 1.5791823 3.8508574 ] [ 2.7047778 3.7430032 4.1860781 ] [ 0.6016671 3.5490614 3.0390119 ] [ 2.8607455 1.3743539 1.7826761 ] [ 3.8516816 3.5381746 2.1178955 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7485715e-10 3.3442317e-10 9.7083e-11 ] [ 1.713841e-10 1.5791823e-10 3.850857400000001e-10 ] [ 2.7047778e-10 3.7430032e-10 4.1860781e-10 ] [ 6.016671e-11 3.5490614e-10 3.0390119e-10 ] [ 2.8607455e-10 1.3743539e-10 1.7826761e-10 ] [ 3.8516816e-10 3.5381746e-10 2.1178955e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.1e-06 2.8e-06 1.6e-06 ] [ 9e-07 4e-06 1.1e-06 ] [ -1.6e-06 -2.8e-06 -6e-06 ] [ 5.1e-06 -2e-06 -1.5e-06 ] [ 8e-07 -1.9e-06 -2e-07 ] [ -2e-06 -2e-07 5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.96674752448e-15 4.48609453824e-15 2.56348259328e-15 ] [ 1.44195895872e-15 6.4087064832e-15 1.76239428288e-15 ] [ -2.56348259328e-15 -4.48609453824e-15 -9.6130597248e-15 ] [ 8.17110076608e-15 -3.2043532416e-15 -2.4032649312e-15 ] [ 1.28174129664e-15 -3.04413557952e-15 -3.2043532416e-16 ] [ -3.2043532416e-15 -3.2043532416e-16 8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }