{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1192297 -4.6674271 -3.10041 ] [ -4.1948153 5.5512504 2.0847249 ] [ -0.5420082 -2.4205001 2.4104409 ] [ 0.0281817 0.070003 -1.7781331 ] [ 0.4868968 0.9114103 0.3702112 ] [ 1.0422407 -0.3635772 -1.5162718 ] [ 1.0602745 0.9188409 1.5294379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.395380279444998e-09 -7.478042578908345e-09 -4.967404416894528e-09 ] [ -6.720835002234139e-09 8.894083607086647e-09 3.340097495579618e-09 ] [ -8.683928663218906e-10 -3.878068670864062e-09 3.861952055800112e-09 ] [ 4.515206087439936e-11 1.121571699858624e-10 -2.848883281490629e-09 ] [ 7.800946697023334e-10 1.460240274616314e-09 5.93143729398313e-10 ] [ 1.669853682786227e-09 -5.825148896959257e-10 -2.429335228738333e-09 ] [ 1.698747015530409e-09 1.472145408214831e-09 2.450429646345448e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.319941 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.576048764783537e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.439243 1.2152041 2.2411046 ] [ 1.3511633 3.3044535 2.9793165 ] [ 2.2127243 1.7324995 4.570649 ] [ 3.2624288 3.3926222 1.4195173 ] [ 4.3096358 2.8059635 4.622839 ] [ 4.735046 1.8488425 2.5121435 ] [ 3.2991766 4.6058977 3.4864762 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.439243e-10 1.2152041e-10 2.2411046e-10 ] [ 1.3511633e-10 3.3044535e-10 2.9793165e-10 ] [ 2.2127243e-10 1.7324995e-10 4.570649e-10 ] [ 3.2624288e-10 3.3926222e-10 1.4195173e-10 ] [ 4.3096358e-10 2.8059635e-10 4.622839e-10 ] [ 4.735046e-10 1.8488425e-10 2.5121435e-10 ] [ 3.2991766e-10 4.6058977e-10 3.4864762e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.08e-05 -2.03e-05 -3.18e-05 ] [ -1.37e-05 6e-07 9.5e-06 ] [ 1.19e-05 -4.9e-05 2.49e-05 ] [ 3.86e-05 1.28e-05 -4.75e-05 ] [ 1.87e-05 3.51e-05 1.93e-05 ] [ 6.9e-06 -9.8e-06 1.89e-05 ] [ -1.6e-06 3.06e-05 6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.741233854464e-14 -3.252418540224e-14 -5.094921654144e-14 ] [ -2.194981970496e-14 9.6130597248e-16 1.52206778976e-14 ] [ 1.906590178752e-14 -7.85066544192e-14 3.989419785791999e-14 ] [ 6.184401756288e-14 2.050786074624e-14 -7.610338948800001e-14 ] [ 2.996070280896e-14 5.623639939008e-14 3.092200878144e-14 ] [ 1.105501868352e-14 -1.570133088384e-14 3.028113813312e-14 ] [ -2.56348259328e-15 4.902660459647999e-14 1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }