{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.6293699 11.6135882 -70.1586128 ] [ -22.3428729 -0.9316197 92.0490888 ] [ 68.9580934 -52.7204468 -55.0744857 ] [ -50.862016 12.8413701 58.6017563 ] [ 41.7684498 13.5753805 10.5026051 ] [ -38.0143484 4.9690305 -48.2038894 ] [ 13.122064 10.6526973 12.2835378 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.023448135592292e-08 1.860701965093812e-08 -1.124064901020133e-07 ] [ -3.579722889681182e-08 -1.49261931511409e-09 1.474788992563511e-07 ] [ 1.104830459706696e-07 -8.446746799700005e-08 -8.823905411810712e-08 ] [ -8.148993359333413e-08 2.057414312276624e-08 9.389036465522228e-08 ] [ 6.692043430796197e-08 2.175015743475923e-08 1.682702848734923e-08 ] [ -6.090570076321529e-08 7.961264560733335e-09 -7.723114526460028e-08 ] [ 2.102386433065258e-08 1.706750270313489e-08 1.968039724601576e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 49.946496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.002310884137446e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1625123 1.195389 1.0774734 ] [ 1.7094838 0.8438686 3.8685338 ] [ 4.5629126 0.8012351 2.5623302 ] [ 3.4171319 3.0251915 4.5263365 ] [ 5.4516818 3.3809964 1.9441922 ] [ 2.6296066 3.8980197 1.3766049 ] [ 4.1780031 5.7803573 3.4615801 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1625123e-10 1.195389e-10 1.0774734e-10 ] [ 1.7094838e-10 8.438686e-11 3.8685338e-10 ] [ 4.5629126e-10 8.012351e-11 2.5623302e-10 ] [ 3.4171319e-10 3.0251915e-10 4.5263365e-10 ] [ 5.4516818e-10 3.3809964e-10 1.9441922e-10 ] [ 2.6296066e-10 3.8980197e-10 1.3766049e-10 ] [ 4.1780031e-10 5.780357300000001e-10 3.4615801e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.6e-06 -1.56e-05 3e-07 ] [ 6.57e-05 6.38e-05 -2.52e-05 ] [ -4.64e-05 2.56e-05 4.28e-05 ] [ -1.14e-05 -2.69e-05 -3.87e-05 ] [ -4.16e-05 3.57e-05 -8.7e-06 ] [ 2.65e-05 -1.44e-05 2.64e-05 ] [ 3.6e-06 -6.83e-05 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.767835882399999e-15 -2.49939554904e-14 4.806529901999999e-16 ] [ 1.052630048538e-13 1.022188692492e-13 -4.037485117679999e-14 ] [ -7.43409958176e-14 4.10157218304e-14 6.857315993519999e-14 ] [ -1.82648136276e-14 -4.309855145459999e-14 -6.200423573579999e-14 ] [ -6.665054797439999e-14 5.719770583379999e-14 -1.39389367158e-14 ] [ 4.2457680801e-14 -2.30713435296e-14 4.22974631376e-14 ] [ 5.767835882399999e-15 -1.094286641022e-13 4.806529901999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.07937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.896634417144058e-18 } }