{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6198089 -1.9578889 -9.4227764 ] [ -0.4108503 -2.5427649 -0.0830114 ] [ -4.0307967 -1.3188837 7.8692971 ] [ -0.879429 -3.4568253 -3.4013538 ] [ 5.7380076 0.1798261 5.3033726 ] [ 0.8952657 1.576845 -2.9478917 ] [ 6.3076117 7.5196916 2.6823636 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.220827967454377e-08 -3.136883821703829e-09 -1.509695205110599e-08 ] [ -6.582547453086663e-10 -4.07395847497085e-09 -1.329989243398771e-10 ] [ -6.458048235937791e-09 -2.113084629694201e-09 1.260800383574924e-08 ] [ -1.409000583453523e-09 -5.538444677849947e-09 -5.449569537429239e-09 ] [ 9.19330162669272e-09 2.881131732296429e-10 8.496939591111311e-09 ] [ 1.434373773944147e-09 2.526384193625376e-09 -4.723043162390367e-09 ] [ 1.010590799882454e-08 1.204787407714615e-08 4.297620248404923e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.558963 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.691732365849223e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7841334 2.2352237 0.7596642 ] [ 1.9302249 1.2891913 2.9889759 ] [ 2.3303328 3.0412008 4.5156626 ] [ 4.2802543 0.6804222 2.1518614 ] [ 5.6813306 2.1731471 3.3219696 ] [ 3.5479425 4.3901987 1.3367892 ] [ 4.2465754 4.029628 3.5602359 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7841334e-10 2.2352237e-10 7.596642e-11 ] [ 1.9302249e-10 1.2891913e-10 2.9889759e-10 ] [ 2.3303328e-10 3.0412008e-10 4.5156626e-10 ] [ 4.2802543e-10 6.804222e-11 2.1518614e-10 ] [ 5.6813306e-10 2.1731471e-10 3.3219696e-10 ] [ 3.5479425e-10 4.3901987e-10 1.3367892e-10 ] [ 4.246575400000001e-10 4.029628e-10 3.5602359e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.7e-06 1.2e-06 -6e-07 ] [ 3.2e-06 -9e-06 9.1e-06 ] [ 6.4e-06 1.5e-06 -1.19e-05 ] [ -7.7e-06 1.01e-05 -3.3e-06 ] [ -9.4e-06 3.6e-06 1.4e-06 ] [ 4.7e-06 -4.8e-06 7e-06 ] [ 2e-07 -2.5e-06 -1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.32587687616e-15 1.92261194496e-15 -9.6130597248e-16 ] [ 5.126965186560001e-15 -1.44195895872e-14 1.457980724928e-14 ] [ 1.025393037312e-14 2.4032649312e-15 -1.906590178752e-14 ] [ -1.233675998016e-14 1.618198387008e-14 -5.28718284864e-15 ] [ -1.506046023552e-14 5.76783583488e-15 2.24304726912e-15 ] [ 7.53023011776e-15 -7.69044777984e-15 1.12152363456e-14 ] [ 3.2043532416e-16 -4.005441552e-15 -2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.243067 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.7626438818288e-18 } }