{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.8395823 -4.9112561 -2.8345963 ] [ -0.7400639 -1.4322989 0.3302666 ] [ -1.2832359 3.1079605 -1.3393551 ] [ -3.5811754 -0.7163811 7.5099053 ] [ 14.6536186 0.0269675 2.431891 ] [ 4.7904389 3.9250081 -6.0981114 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.217345520269749e-08 -7.868699702181387e-09 -4.541523921266183e-09 ] [ -1.185713078478069e-09 -2.294795811577557e-09 5.291454251511053e-10 ] [ -2.055970557951247e-09 4.979501651469878e-09 -2.145883428169246e-09 ] [ -5.737675500864088e-09 -1.147769050002987e-09 1.203219469608201e-08 ] [ 2.347768513104003e-08 4.3206698021424e-11 3.896318904533933e-09 ] [ 7.67512920895087e-09 6.288556214270628e-09 -9.770251516113958e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.088526 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.616360049553294e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.128492 0.5364699 -0.1658537 ] [ 0.3144293 0.3907575 2.1584706 ] [ 0.1775263 2.5288468 0.9352727 ] [ 1.7828674 2.2697264 2.7905617 ] [ 2.7338365 0.2773489 1.6894339 ] [ 2.5969355 2.4154363 0.466237 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.128492e-10 5.364699e-11 -1.658537e-11 ] [ 3.144293e-11 3.907575e-11 2.1584706e-10 ] [ 1.775263e-11 2.5288468e-10 9.352727e-11 ] [ 1.7828674e-10 2.2697264e-10 2.7905617e-10 ] [ 2.7338365e-10 2.773489e-11 1.6894339e-10 ] [ 2.5969355e-10 2.4154363e-10 4.66237e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.26e-05 -1.26e-05 -5e-06 ] [ -2.9e-06 -1.7e-05 -1.6e-05 ] [ -1.73e-05 1.92e-05 -2.11e-05 ] [ 3.22e-05 1e-05 -2.2e-06 ] [ 1.94e-05 -1.83e-05 2.37e-05 ] [ -8.8e-06 1.87e-05 2.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.620919163008e-14 -2.018742542208e-14 -8.010883104e-15 ] [ -4.646312200320001e-15 -2.72370025536e-14 -2.56348259328e-14 ] [ -2.771765553984e-14 3.076179111936e-14 -3.380592669888e-14 ] [ 5.159008718975999e-14 1.6021766208e-14 -3.52478856576e-15 ] [ 3.108222644352e-14 -2.931983216064e-14 3.797158591296e-14 ] [ -1.409915426304e-14 2.996070280896e-14 3.28446207264e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }