{ "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" [ [ 0.0221122 0.00357 0.1110342 ] [ 0.2725629 2.182164 0.260904 ] [ 0.3472204 2.881652 2.59775 ] [ 1.734388 0.2655593 2.566686 ] [ 2.338795 2.363947 0.0295877 ] [ 1.600298 1.908592 1.497057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.21122e-12 3.57e-13 1.110342e-11 ] [ 2.725629e-11 2.182164e-10 2.60904e-11 ] [ 3.472204e-11 2.881652e-10 2.59775e-10 ] [ 1.734388e-10 2.655593e-11 2.566686e-10 ] [ 2.338795e-10 2.363947e-10 2.95877e-12 ] [ 1.600298e-10 1.908592e-10 1.497057e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2836654 -0.1399695 0.3955869 ] [ -9.1014233 -0.662369 -4.8757678 ] [ -1.9270436 2.7038763 2.9507184 ] [ 0.4409674 -2.3848974 0.1874148 ] [ 9.6652199 3.3304902 -8.6201789 ] [ 1.205945 -2.8471307 9.9622265 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.544820720098804e-10 -2.242558605250656e-10 6.338000826747475e-10 ] [ -1.458208762726439e-08 -1.061232126142675e-09 -7.81184117760945e-09 ] [ -3.087464203182267e-09 4.332087393395207e-09 4.727572035044382e-09 ] [ 7.06507658814962e-10 -3.821026857286705e-09 3.002716109519078e-10 ] [ 1.548538935867091e-08 5.336033534243517e-09 -1.381104910069346e-08 ] [ 1.932136884970656e-09 -4.561606243901939e-09 1.596124638941421e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.536923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.20754818233698e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.0454697 0.008642 0.4911795 ] [ 0.0117702 2.2538856 0.048692 ] [ 0.0832386 2.9353655 2.2790649 ] [ 1.6685007 -0.1052928 2.1369088 ] [ 2.3349758 2.4086038 -0.1025051 ] [ 2.2623607 2.1042801 2.2096789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.54697e-12 8.642000000000001e-13 4.911795e-11 ] [ 1.17702e-12 2.2538856e-10 4.8692e-12 ] [ 8.32386e-12 2.9353655e-10 2.2790649e-10 ] [ 1.6685007e-10 -1.052928e-11 2.1369088e-10 ] [ 2.3349758e-10 2.4086038e-10 -1.025051e-11 ] [ 2.2623607e-10 2.1042801e-10 2.2096789e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.9e-06 4.8e-06 -5.3e-06 ] [ 5e-07 -9.3e-06 4.4e-06 ] [ 1.8e-06 -8.6e-06 5.9e-06 ] [ -3.8e-06 9.5e-06 -4.7e-06 ] [ 7e-06 -6e-06 -8.7e-06 ] [ -6e-07 9.6e-06 8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.850665441919999e-15 7.69044777984e-15 -8.491536090240001e-15 ] [ 8.010883104e-16 -1.490024257344e-14 7.04957713152e-15 ] [ 2.88391791744e-15 -1.377871893888e-14 9.45284206272e-15 ] [ -6.08827115904e-15 1.52206778976e-14 -7.53023011776e-15 ] [ 1.12152363456e-14 -9.6130597248e-15 -1.393893660096e-14 ] [ -9.6130597248e-16 1.538089555968e-14 1.345828361472e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.181251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.272086880589662e-18 } }