{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.336271 1.731327 1.289714 ] [ 2.769645 4.287083 1.737277 ] [ 4.480326 1.077167 0.108092 ] [ 5.392167 2.307543 2.197028 ] [ 3.12468 2.46702 3.187134 ] [ 4.416093 3.533887 0.3236582 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.336271e-10 1.731327e-10 1.289714e-10 ] [ 2.769645e-10 4.287083e-10 1.737277e-10 ] [ 4.480326e-10 1.077167e-10 1.08092e-11 ] [ 5.392167e-10 2.307543e-10 2.197028e-10 ] [ 3.12468e-10 2.467020000000001e-10 3.187134e-10 ] [ 4.416093e-10 3.533887e-10 3.236582e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1336336 1.0368503 -2.1952098 ] [ -0.7687194 -1.19268 -0.0089668 ] [ -0.6806583 1.9436469 2.1457125 ] [ -1.1307847 -0.5505259 -1.178851 ] [ 1.2178372 0.1993982 1.582387 ] [ 0.2286915 -1.4366894 -0.345072 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.816281250473339e-09 1.661217309929466e-09 -3.517113819311044e-09 ] [ -1.231624250635404e-09 -1.910884012095744e-09 -1.436639732338944e-11 ] [ -1.090534815013473e-09 3.114065622270396e-09 3.43781040245832e-09 ] [ -1.811716809498342e-09 -8.820397261248788e-10 -1.888727511606701e-09 ] [ 1.951190289780534e-09 3.194711342696026e-10 2.53526345645785e-09 ] [ 3.664041746756832e-10 -2.301830168031179e-09 -5.528662908926977e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -24.494509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.924452965777519e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4398224 1.9605962 1.0316463 ] [ 3.1605258 4.1320544 1.9681691 ] [ 4.5840085 1.088301 0.3631853 ] [ 5.104449 2.6158419 2.1523256 ] [ 3.0444793 2.2467942 3.3463215 ] [ 4.1858969 3.3604393 -0.0187447 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4398224e-10 1.9605962e-10 1.0316463e-10 ] [ 3.1605258e-10 4.132054400000001e-10 1.9681691e-10 ] [ 4.584008500000001e-10 1.088301e-10 3.631853e-11 ] [ 5.104449e-10 2.6158419e-10 2.1523256e-10 ] [ 3.0444793e-10 2.2467942e-10 3.3463215e-10 ] [ 4.185896900000001e-10 3.3604393e-10 -1.87447e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.46e-05 9.7e-06 -2.34e-05 ] [ -2.28e-05 -1e-05 -1.88e-05 ] [ 6.7e-06 -1.83e-05 -1.7e-05 ] [ -1.17e-05 -1.9e-06 6.8e-06 ] [ 3.31e-05 9.4e-06 3.69e-05 ] [ 1.93e-05 1.12e-05 1.55e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.941354487168e-14 1.554111322176e-14 -3.749093292672001e-14 ] [ -3.652962695424e-14 -1.6021766208e-14 -3.012092047104e-14 ] [ 1.073458335936e-14 -2.931983216064e-14 -2.72370025536e-14 ] [ -1.874546646336e-14 -3.04413557952e-15 1.089480102144e-14 ] [ 5.303204614848e-14 1.506046023552e-14 5.912031730752001e-14 ] [ 3.092200878144e-14 1.794437815296e-14 2.48337376224e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.320379 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.216989588439529e-18 } }