{ "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" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.1150871 -17.4321175 -7.3921375 ] [ -10.2118188 3.6420577 17.6860793 ] [ -4.1644914 7.3337915 -9.9398148 ] [ 8.540725 -6.2754799 0.6118112 ] [ 14.9506723 12.7317482 -0.9659382 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.460397944817567e-08 -2.792933110953854e-08 -1.184350988023896e-08 ] [ -1.636113733720591e-08 5.83521969854462e-09 2.833622276807483e-08 ] [ -6.672250758602662e-09 1.175002928312176e-08 -1.592533888764183e-08 ] [ 1.368374991968208e-08 -1.005442718008032e-08 9.80229600983593e-10 ] [ 2.395361762430217e-08 2.039850930795248e-08 -1.547603601177635e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.9294202 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.48909531533926e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.3976574 1.6989295 3.007394 ] [ 0.272536 2.1476988 5.0231149 ] [ 1.682592 3.77255 1.7574341 ] [ 3.799235 1.6172942 3.4187542 ] [ 4.0840297 3.6913545 2.1695539 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3976574e-10 1.6989295e-10 3.007394e-10 ] [ 2.72536e-11 2.1476988e-10 5.0231149e-10 ] [ 1.682592e-10 3.77255e-10 1.7574341e-10 ] [ 3.799235e-10 1.6172942e-10 3.4187542e-10 ] [ 4.084029700000001e-10 3.6913545e-10 2.1695539e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.14e-05 1.57e-05 -2.15e-05 ] [ -6.9e-06 1.21e-05 -6.1e-06 ] [ -2.01e-05 -7.8e-06 2.03e-05 ] [ 2.53e-05 -1.17e-05 8.5e-06 ] [ -9.8e-06 -8.4e-06 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.826481347712e-14 2.515417294656e-14 -3.44467973472e-14 ] [ -1.105501868352e-14 1.938633711168e-14 -9.77327738688e-15 ] [ -3.220375007808e-14 -1.249697764224e-14 3.252418540224e-14 ] [ 4.053506850624e-14 -1.874546646336e-14 1.36185012768e-14 ] [ -1.570133088384e-14 -1.345828361472e-14 -1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.7587726 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.563527730742363e-18 } }