{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0034806 -0.0765101 -1.1446502 ] [ 0.4227039 -2.404326 4.2808634 ] [ -3.1025586 1.1011267 -2.9352917 ] [ -1.3010067 1.0655398 -5.0506008 ] [ 0.8587376 0.1579369 3.4919893 ] [ 0.5477407 -0.4089616 0.3309207 ] [ 2.5709025 0.5651942 1.0267692 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.576535946356481e-12 -1.225826934750701e-10 -1.833931789434044e-09 ] [ 6.772463061009811e-10 -3.852154905981581e-09 6.8586992563184e-09 ] [ -4.970846853581979e-09 1.764199455278656e-09 -4.702855736968287e-09 ] [ -2.084442518244159e-09 1.707182956091908e-09 -8.091954522753776e-09 ] [ 1.375849306121902e-09 2.530428087416275e-10 5.594783616543757e-09 ] [ 8.775773438006265e-10 -6.552287143249613e-10 5.301934088787705e-10 ] [ 4.119039879856272e-09 9.055409334517593e-10 1.645065607197519e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -21.21276 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.398658813464141e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9881131 1.632291 2.6030077 ] [ 2.7624681 1.7219345 4.821522 ] [ 1.5531133 3.9382986 2.7531753 ] [ 4.1769708 2.0942736 1.8182307 ] [ 4.9549613 2.1847179 4.035436 ] [ 3.7456238 4.4010507 1.9671332 ] [ 3.3922496 4.0273758 4.3485021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9881131e-10 1.632291e-10 2.6030077e-10 ] [ 2.7624681e-10 1.7219345e-10 4.821522e-10 ] [ 1.5531133e-10 3.9382986e-10 2.7531753e-10 ] [ 4.1769708e-10 2.0942736e-10 1.8182307e-10 ] [ 4.9549613e-10 2.1847179e-10 4.035436e-10 ] [ 3.745623800000001e-10 4.4010507e-10 1.9671332e-10 ] [ 3.3922496e-10 4.0273758e-10 4.3485021e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-05 -4.83e-05 -1e-05 ] [ 2.02e-05 2.9e-05 -4.14e-05 ] [ -1.87e-05 1.91e-05 1.91e-05 ] [ 7e-07 3.4e-06 -1.7e-06 ] [ -5.25e-05 -5e-06 6.05e-05 ] [ -1.9e-05 2.87e-05 -4.66e-05 ] [ 5.93e-05 -2.7e-05 2.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-14 -7.738513078464e-14 -1.6021766208e-14 ] [ 3.236396774016e-14 4.64631220032e-14 -6.633011210111999e-14 ] [ -2.996070280896e-14 3.060157345728e-14 3.060157345728e-14 ] [ 1.12152363456e-15 5.44740051072e-15 -2.72370025536e-15 ] [ -8.4114272592e-14 -8.010883104e-15 9.69316855584e-14 ] [ -3.04413557952e-14 4.598246901696e-14 -7.466143052928e-14 ] [ 9.500907361344e-14 -4.32587687616e-14 3.220375007808e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.906204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669978452007545e-18 } }