{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.79141 2.530899 1.169625 ] [ 2.427567 4.27143 3.28825 ] [ 4.049049 2.026656 0.8582536 ] [ 3.63347 2.471275 3.089518 ] [ 3.6938 4.301317 1.502863 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.79141e-10 2.530899e-10 1.169625e-10 ] [ 2.427567e-10 4.27143e-10 3.28825e-10 ] [ 4.049049e-10 2.026656e-10 8.582536e-11 ] [ 3.63347e-10 2.471275e-10 3.089518e-10 ] [ 3.6938e-10 4.301317e-10 1.502863e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.5156272 1.6216237 2.0495939 ] [ -2.1274039 0.0827496 -0.2011516 ] [ -0.0618316 0.1158889 -0.3313948 ] [ 0.3159588 -1.5131401 -0.0003466 ] [ 0.3576495 -0.307122 -1.5167009 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.428302465688566e-09 2.598127579875193e-09 3.283811428714293e-09 ] [ -3.408476791578741e-09 1.325794745005517e-10 -3.222803907565133e-10 ] [ -9.906514394665728e-11 1.856744861902291e-10 -5.309530008146919e-10 ] [ 5.062218024960231e-10 -2.424317692214974e-09 -5.553144167692801e-13 ] [ 5.730176673408096e-10 -4.920636881333377e-10 -2.430022722726319e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.196498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.235835691763396e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8667179 2.6891729 1.4155014 ] [ 2.2015604 4.2173705 3.1756886 ] [ 4.0365594 2.0232608 0.7877155 ] [ 3.6957815 2.3993341 3.0873248 ] [ 3.7946769 4.2724388 1.4422793 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8667179e-10 2.6891729e-10 1.4155014e-10 ] [ 2.2015604e-10 4.217370500000001e-10 3.1756886e-10 ] [ 4.0365594e-10 2.0232608e-10 7.877155e-11 ] [ 3.6957815e-10 2.3993341e-10 3.0873248e-10 ] [ 3.7946769e-10 4.2724388e-10 1.4422793e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.8e-06 -8e-07 -1.1e-06 ] [ 1.5e-06 -9.8e-06 -1e-05 ] [ -1.19e-05 9.4e-06 1.11e-05 ] [ 5.9e-06 -6.9e-06 6.3e-06 ] [ 7.3e-06 8.1e-06 -6.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.48609453824e-15 -1.28174129664e-15 -1.76239428288e-15 ] [ 2.4032649312e-15 -1.570133088384e-14 -1.6021766208e-14 ] [ -1.906590178752e-14 1.506046023552e-14 1.778416049088e-14 ] [ 9.45284206272e-15 -1.105501868352e-14 1.009371271104e-14 ] [ 1.169588933184e-14 1.297763062848e-14 -1.009371271104e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.115797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.383123628295878e-18 } }