{ "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" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0321729 -0.8554294 0.8232734 ] [ -2.1183697 -0.9181039 -1.1630898 ] [ 0.3634484 -0.8384752 -0.2886773 ] [ 0.3114647 -0.5426707 0.9598499 ] [ -0.486447 0.0857907 -0.4945833 ] [ 1.2545056 0.9506805 0.1783763 ] [ 0.7075709 2.118208 -0.0151492 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.154666820333632e-11 -1.370548985424971e-09 1.319029394006527e-09 ] [ -3.39400240755111e-09 -1.470964604045301e-09 -1.863475285450948e-09 ] [ 5.823085293471667e-10 -1.343385362560604e-09 -4.625120210156679e-10 ] [ 4.990214605444857e-10 -8.694543083331705e-10 1.537849069257218e-09 ] [ -7.793740106582976e-10 1.374518538220665e-10 -7.924098002981127e-10 ] [ 2.009939542982677e-09 1.523158070950455e-09 2.85790337564807e-10 ] [ 1.133653553538415e-09 3.393743335591527e-09 -2.427169406382336e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -19.316493 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.094843348044686e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0234736 2.0243416 1.3989233 ] [ 2.3914207 1.3259508 3.6442094 ] [ 1.8279346 4.2201501 2.1172069 ] [ 2.1950629 3.5235637 4.3567207 ] [ 4.3525716 2.1154324 2.3068998 ] [ 4.1051894 4.561875 1.8469347 ] [ 4.4732722 3.8634394 4.0921811 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0234736e-10 2.0243416e-10 1.3989233e-10 ] [ 2.3914207e-10 1.3259508e-10 3.6442094e-10 ] [ 1.8279346e-10 4.2201501e-10 2.1172069e-10 ] [ 2.1950629e-10 3.5235637e-10 4.3567207e-10 ] [ 4.3525716e-10 2.1154324e-10 2.3068998e-10 ] [ 4.105189400000001e-10 4.561875e-10 1.8469347e-10 ] [ 4.4732722e-10 3.8634394e-10 4.092181100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.76e-05 1.01e-05 3.2e-06 ] [ 7.58e-05 3.13e-05 1.53e-05 ] [ -1.01e-05 -1.28e-05 -1.11e-05 ] [ -3.9e-05 1.6e-06 -2.7e-05 ] [ -4.44e-05 6.7e-06 -1.84e-05 ] [ 1.65e-05 1.1e-06 -3.26e-05 ] [ 1.88e-05 -3.8e-05 7.06e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.819830852608e-14 1.618198387008e-14 5.126965186560001e-15 ] [ 1.2144498785664e-13 5.014812823104e-14 2.451330229824e-14 ] [ -1.618198387008e-14 -2.050786074624e-14 -1.778416049088e-14 ] [ -6.248488821120001e-14 2.56348259328e-15 -4.32587687616e-14 ] [ -7.113664196352e-14 1.073458335936e-14 -2.948004982272e-14 ] [ 2.64359142432e-14 1.76239428288e-15 -5.223095783807999e-14 ] [ 3.012092047104e-14 -6.08827115904e-14 1.1311366942848e-13 ] ] } "relaxed-potential-energy" { "source-value" -22.303661 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573440421244875e-18 } }