{ "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" [ [ 1.743709 2.680969 1.034902 ] [ 2.749822 1.528948 3.390438 ] [ 1.938557 3.742026 2.98984 ] [ 3.932402 1.721019 1.334077 ] [ 5.171354 1.721023 3.429234 ] [ 4.220666 3.803748 1.650722 ] [ 4.237092 3.532846 4.042988 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.743709e-10 2.680969e-10 1.034902e-10 ] [ 2.749822e-10 1.528948e-10 3.390438e-10 ] [ 1.938557e-10 3.742026e-10 2.98984e-10 ] [ 3.932402e-10 1.721019e-10 1.334077e-10 ] [ 5.171354e-10 1.721023e-10 3.429234e-10 ] [ 4.220666e-10 3.803748e-10 1.650722e-10 ] [ 4.237092e-10 3.532846e-10 4.042988e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.2521596 -1.9646239 -3.3972164 ] [ -4.2742612 -7.5012903 3.8575508 ] [ -1.9749233 3.0483486 1.9343923 ] [ 0.5718783 -1.8504292 -6.1259765 ] [ 1.9850589 -2.2653315 1.8515262 ] [ 4.1651782 4.7192152 -2.2345041 ] [ 2.7792287 5.8141112 4.1142277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.21053407823028e-09 -3.147674481244917e-09 -5.442940691878342e-09 ] [ -6.848121365832553e-09 -1.201839194449382e-08 6.180477705308336e-09 ] [ -3.164175939133184e-09 4.883992858968412e-09 3.09923811851554e-09 ] [ 9.162500422028486e-10 -2.964714402685647e-09 -9.814896327870212e-09 ] [ 3.180414960490965e-09 -3.629461167661795e-09 2.966471990438665e-09 ] [ 6.673351133505827e-09 7.561016261963996e-09 -3.580070228101745e-09 ] [ 4.452815246996377e-09 9.315233035371433e-09 6.591719433587756e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.782897 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.887828209869446e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0461693 2.8293171 1.0739684 ] [ 2.3216539 0.9260587 4.1530043 ] [ 1.86493 3.3062101 3.3808616 ] [ 4.2116227 1.8331948 1.0106647 ] [ 4.6495218 1.5065891 3.3554067 ] [ 4.6840145 4.4057789 1.2275459 ] [ 4.2156898 3.9234302 3.6707494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0461693e-10 2.8293171e-10 1.0739684e-10 ] [ 2.3216539e-10 9.260587000000001e-11 4.1530043e-10 ] [ 1.86493e-10 3.3062101e-10 3.3808616e-10 ] [ 4.211622700000001e-10 1.8331948e-10 1.0106647e-10 ] [ 4.6495218e-10 1.5065891e-10 3.3554067e-10 ] [ 4.6840145e-10 4.4057789e-10 1.2275459e-10 ] [ 4.2156898e-10 3.9234302e-10 3.6707494e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 1.02e-05 -1.13e-05 ] [ -4.2e-06 -1.25e-05 -5.3e-06 ] [ 1.27e-05 -3e-06 -4e-07 ] [ -4e-07 -3.7e-06 1.4e-06 ] [ -6.7e-06 7e-07 1.5e-05 ] [ -2.11e-05 -3.3e-06 -7.1e-06 ] [ 1.57e-05 1.15e-05 7.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.4087064832e-15 1.634220153216e-14 -1.810459581504e-14 ] [ -6.72914180736e-15 -2.002720776e-14 -8.491536090240001e-15 ] [ 2.034764308416e-14 -4.8065298624e-15 -6.408706483200001e-16 ] [ -6.408706483200001e-16 -5.928053496960001e-15 2.24304726912e-15 ] [ -1.073458335936e-14 1.12152363456e-15 2.4032649312e-14 ] [ -3.380592669888e-14 -5.28718284864e-15 -1.137545400768e-14 ] [ 2.515417294656e-14 1.84250311392e-14 1.233675998016e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.891963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026826143961863e-18 } }