{ "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" [ [ 2.966235 1.459279 2.017921 ] [ 1.582263 2.973277 1.988687 ] [ 1.824476 2.329709 3.996255 ] [ 2.988754 4.654766 3.111716 ] [ 4.721481 3.212435 2.659559 ] [ 3.387912 3.682172 0.4517977 ] [ 4.184602 3.482657 5.105901 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.966235e-10 1.459279e-10 2.017921e-10 ] [ 1.582263e-10 2.973277e-10 1.988687e-10 ] [ 1.824476e-10 2.329709e-10 3.996255e-10 ] [ 2.988754e-10 4.654766e-10 3.111716e-10 ] [ 4.721481e-10 3.212435e-10 2.659559e-10 ] [ 3.387912e-10 3.682172e-10 4.517977e-11 ] [ 4.184602e-10 3.482657e-10 5.105901e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.4841812 -7.879857 -2.1548109 ] [ -10.9498342 7.721458 -6.8618397 ] [ -1.1442179 -1.4046955 8.978937 ] [ -2.8435982 4.5831084 1.5754696 ] [ 7.7831511 -2.2292552 -1.2964823 ] [ 0.4860771 -0.3387679 0.063858 ] [ -0.8157591 -0.4519907 -0.3051317 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.199098014447089e-08 -1.262492266064723e-08 -3.452387646225007e-09 ] [ -1.754356835687627e-08 1.237113948608913e-08 -1.099387914301729e-08 ] [ -1.833239168480872e-09 -2.250570289442967e-09 1.438584294103609e-08 ] [ -4.555946554988964e-09 7.342949129072095e-09 2.524180559901127e-09 ] [ 1.24699827285738e-08 -3.571660563236828e-09 -2.077193630341012e-09 ] [ 7.787813655262637e-10 -5.427660092575124e-10 1.023117946510464e-10 ] [ -1.306990158224849e-09 -7.241689323590267e-10 -4.888748760049594e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.996515 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.922053586407652e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1192428 1.4142667 1.9982167 ] [ 1.117921 3.1391677 1.7834472 ] [ 1.9919367 2.3688803 4.133639 ] [ 2.8756684 4.6722695 3.0621313 ] [ 5.0016312 3.071963 2.6696367 ] [ 3.4319323 3.6797366 0.6578555 ] [ 4.1173906 3.4480113 5.0269103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1192428e-10 1.4142667e-10 1.9982167e-10 ] [ 1.117921e-10 3.1391677e-10 1.7834472e-10 ] [ 1.9919367e-10 2.3688803e-10 4.133639e-10 ] [ 2.8756684e-10 4.6722695e-10 3.0621313e-10 ] [ 5.0016312e-10 3.071963e-10 2.6696367e-10 ] [ 3.4319323e-10 3.6797366e-10 6.578555e-11 ] [ 4.1173906e-10 3.4480113e-10 5.0269103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.3e-06 -2.4e-06 -3.42e-05 ] [ -1e-07 -8.4e-06 3.63e-05 ] [ -4.7e-06 -9.8e-06 -5.6e-06 ] [ 1.04e-05 2.8e-06 -7.5e-06 ] [ -2.55e-05 -2.2e-06 4.96e-05 ] [ 1.23e-05 2.6e-06 -2.37e-05 ] [ 1.29e-05 1.72e-05 -1.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.491536090240001e-15 -3.84522388992e-15 -5.479444043136e-14 ] [ -1.6021766208e-16 -1.345828361472e-14 5.815901133504e-14 ] [ -7.53023011776e-15 -1.570133088384e-14 -8.972189076479999e-15 ] [ 1.666263685632e-14 4.48609453824e-15 -1.2016324656e-14 ] [ -4.08555038304e-14 -3.52478856576e-15 7.946796039168e-14 ] [ 1.970677243584e-14 4.16565921408e-15 -3.797158591296e-14 ] [ 2.066807840832e-14 2.755743787776e-14 -2.371221398784e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.704052 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.676284158702748e-18 } }