{ "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" [ [ 2.061869 2.942366 1.677644 ] [ 1.882152 2.580028 5.41738 ] [ 1.143094 3.952812 3.395101 ] [ 3.99886 1.876175 2.533949 ] [ 4.004626 1.895608 4.810911 ] [ 3.218518 3.766044 3.544324 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.061869e-10 2.942366e-10 1.677644e-10 ] [ 1.882152e-10 2.580028e-10 5.41738e-10 ] [ 1.143094e-10 3.952812e-10 3.395101e-10 ] [ 3.99886e-10 1.876175e-10 2.533949e-10 ] [ 4.004626e-10 1.895608e-10 4.810911e-10 ] [ 3.218518e-10 3.766044e-10 3.544324e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6266451 -5.3169528 -9.1783637 ] [ 9.4372579 -3.0945505 -2.3912147 ] [ -5.7562798 1.9425371 1.5093313 ] [ -0.2330376 -0.6690153 1.480691 ] [ -8.363679 0.3156912 1.5851381 ] [ 7.5423836 6.8222904 6.994418 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.208349370358879e-09 -8.518697470057099e-09 -1.470535973733938e-08 ] [ 1.512015397184011e-08 -4.95801646298495e-09 -3.831148287653285e-09 ] [ -9.2225769183433e-09 3.112287526656632e-09 2.418215321901671e-09 ] [ -3.733673944873422e-10 -1.071880672617498e-09 2.372328502828973e-09 ] [ -1.340009095767592e-08 5.05793060032297e-10 2.539671204559333e-09 ] [ 1.208423066902534e-08 1.093051417918828e-08 1.120629299570269e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0542095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.290426615992526e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4249316 2.7452515 1.3731675 ] [ 3.2936782 1.8581863 6.5339939 ] [ 1.7285156 4.6296818 2.2693156 ] [ 3.4376345 1.1098425 2.4493903 ] [ 3.7538047 0.8755175 4.6165486 ] [ 1.6705544 5.7945534 4.1368932 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4249316e-10 2.7452515e-10 1.3731675e-10 ] [ 3.2936782e-10 1.8581863e-10 6.5339939e-10 ] [ 1.7285156e-10 4.6296818e-10 2.2693156e-10 ] [ 3.4376345e-10 1.1098425e-10 2.4493903e-10 ] [ 3.7538047e-10 8.755175e-11 4.6165486e-10 ] [ 1.6705544e-10 5.7945534e-10 4.1368932e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2590679 -0.4256012 0.0863594 ] [ 0.1519715 -0.2777579 -0.2634115 ] [ -0.137121 0.4227224 0.1917714 ] [ -0.1287221 0.1404322 -0.0417157 ] [ -0.0890755 0.149752 0.2418709 ] [ -0.0561208 -0.0095474 -0.2148744 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.150725325797524e-10 -6.81888292424425e-10 1.383630116663155e-10 ] [ 2.434851843279072e-10 -4.450172136225043e-10 -4.220317469498593e-10 ] [ -2.196920604207168e-10 6.772759463684659e-10 3.072516536180852e-10 ] [ -2.062355392002797e-10 2.249971876475098e-10 -6.683591926030657e-11 ] [ -1.427146835860704e-10 2.399291533180416e-10 3.875199012318547e-10 ] [ -8.991543370059264e-11 -1.529662106942592e-11 -3.442667400884275e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.484741 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.160493676774321e-18 } }