{ "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" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.9611743 -7.2706107 2.6934885 ] [ -0.5389763 -3.3866156 15.4145535 ] [ -6.1585582 14.0189611 4.3052505 ] [ 15.7335738 -9.2961694 -17.5410625 ] [ 7.1325652 -7.5936473 -0.8393907 ] [ 11.7925698 13.5280819 -4.0328393 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.47987401226613e-08 -1.164880257845038e-08 4.315444338647708e-09 ] [ -8.63535234139774e-10 -5.42595638265989e-09 2.469683744124292e-08 ] [ -9.867098047169097e-09 2.246085190737494e-08 6.897771754616816e-09 ] [ 2.520796431167459e-08 -1.48941053983858e-08 -2.810388047303362e-08 ] [ 1.142762930392154e-08 -1.216636427089719e-08 -1.344852166336904e-09 ] [ 1.889377978837405e-08 2.167437672301832e-08 -6.461320895136915e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.4386016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.031577703915501e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3198348 0.4733074 1.4506756 ] [ 0.6216137 2.7236113 0.3321096 ] [ 0.9228469 2.5620342 2.8256999 ] [ 2.0462373 0.7461098 -0.3505757 ] [ 2.7213722 0.9676335 2.0786721 ] [ 3.1238775 2.9098319 0.5292518 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.198348e-11 4.733074e-11 1.4506756e-10 ] [ 6.216137000000001e-11 2.7236113e-10 3.321096e-11 ] [ 9.228469000000001e-11 2.5620342e-10 2.8256999e-10 ] [ 2.0462373e-10 7.461098000000001e-11 -3.505757e-11 ] [ 2.7213722e-10 9.676335e-11 2.0786721e-10 ] [ 3.1238775e-10 2.9098319e-10 5.292518000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.96e-05 -7.1e-06 2.32e-05 ] [ 5.75e-05 8.5e-06 -2.31e-05 ] [ 4.71e-05 -8.7e-06 -2.06e-05 ] [ 3.51e-05 4.22e-05 -1.94e-05 ] [ 1.45e-05 1.82e-05 1.76e-05 ] [ -0.0001146 -5.3e-05 2.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.34461947064e-14 -1.13754541014e-14 3.71704979088e-14 ] [ 9.212515645499998e-14 1.3618501389e-14 -3.70102802454e-14 ] [ 7.546251946139999e-14 -1.39389367158e-14 -3.300483866039999e-14 ] [ 5.62363998534e-14 6.761185395480001e-14 -3.10822266996e-14 ] [ 2.3231561193e-14 2.915961473879999e-14 2.81983087584e-14 ] [ -1.836094422564e-13 -8.491536160199999e-14 3.572853893819999e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.071805 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.536293024120437e-18 } }