{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.5862433 -8.2387937 -3.8906706 ] [ -6.5191162 1.3386613 5.223121 ] [ -2.4998431 6.4144925 -7.7553982 ] [ 4.2726932 -0.6993629 -1.9939798 ] [ 6.1572268 -3.9042002 4.983515 ] [ 0.4329389 0.2105416 -0.9188302 ] [ 1.7423437 4.8786613 4.3522428 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.74579517176064e-09 -1.320000264973433e-08 -6.233541474553909e-09 ] [ -1.044477556391854e-08 2.144771838029735e-09 8.368362353809517e-09 ] [ -4.005190170488197e-09 1.027714991779694e-08 -1.24255176810344e-08 ] [ 6.845609152891139e-09 -1.120502887834889e-09 -3.19470781790746e-09 ] [ 9.864964827923198e-09 -6.255218283362684e-09 7.984471222406111e-09 ] [ 6.936445838148691e-10 3.373248292258253e-10 -1.472128264924988e-09 ] [ 2.791542341538169e-09 7.816477075661734e-09 6.973061662205131e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.600551 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.179048484219806e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4867711 1.6383213 2.1874164 ] [ 1.5974638 3.2068717 4.03903 ] [ 2.046074 4.1510921 1.6508758 ] [ 4.8285501 2.1055052 2.3924093 ] [ 5.0925024 2.1932049 4.7726158 ] [ 4.2904196 4.491239 2.4406349 ] [ 3.6809091 4.1297128 4.7818787 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4867711e-10 1.6383213e-10 2.1874164e-10 ] [ 1.5974638e-10 3.2068717e-10 4.03903e-10 ] [ 2.046074e-10 4.1510921e-10 1.6508758e-10 ] [ 4.8285501e-10 2.1055052e-10 2.392409300000001e-10 ] [ 5.0925024e-10 2.1932049e-10 4.7726158e-10 ] [ 4.2904196e-10 4.491239000000001e-10 2.4406349e-10 ] [ 3.6809091e-10 4.1297128e-10 4.7818787e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.56e-05 2.36e-05 -1.19e-05 ] [ 2.64e-05 3.64e-05 -2.99e-05 ] [ 2.6e-06 -4.72e-05 2.87e-05 ] [ -2.11e-05 5.18e-05 4.43e-05 ] [ -2.36e-05 -5.2e-06 -9.1e-06 ] [ -4.02e-05 -2.38e-05 1.43e-05 ] [ 4.02e-05 -3.58e-05 -3.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.499395528448e-14 3.781136825088e-14 -1.906590178752e-14 ] [ 4.229746278912e-14 5.831922899712e-14 -4.790508096192e-14 ] [ 4.16565921408e-15 -7.562273650176e-14 4.598246901696e-14 ] [ -3.380592669888e-14 8.299274895744e-14 7.097642430144e-14 ] [ -3.781136825088e-14 -8.33131842816e-15 -1.457980724928e-14 ] [ -6.440750015616e-14 -3.813180357504e-14 2.291112567744e-14 ] [ 6.440750015616e-14 -5.735792302464001e-14 -5.831922899712e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }