{ "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" [ [ -1272.0380934 -365.4350872 -165.5427535 ] [ 2.8689456 1.6819388 -3.0729219 ] [ 85.990823 79.3143023 -209.5801459 ] [ -172.8111383 -93.74692 305.3992905 ] [ 1269.1348461 364.9695945 174.0894141 ] [ 86.854617 13.2161716 -101.2928832 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.038029694012487e-06 -5.854915531318494e-07 -2.652287294005574e-07 ] [ 4.596557566667029e-09 2.694763022976407e-09 -4.923363625724316e-09 ] [ 1.377724862139509e-07 1.270755208401237e-07 -3.35784409944833e-07 ] [ -2.768739655980955e-07 -1.501991234960079e-07 4.893036032480076e-07 ] [ 2.033378179064026e-06 5.847457516107562e-07 2.789219891997899e-07 ] [ 1.391564367659382e-07 2.117464115400093e-08 -1.622890893164651e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 180.64931 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.894321010456517e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.2078295 0.5705613 -0.0872982 ] [ 0.36657 0.3435658 1.9485938 ] [ 0.8081211 2.3635691 1.1518616 ] [ 1.2442472 1.8983605 3.2663596 ] [ 2.4757783 0.9698386 1.6855658 ] [ 2.6315408 2.2726904 -0.0909605 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2078295e-10 5.705613000000001e-11 -8.729820000000001e-12 ] [ 3.6657e-11 3.435658e-11 1.9485938e-10 ] [ 8.081211e-11 2.3635691e-10 1.1518616e-10 ] [ 1.2442472e-10 1.8983605e-10 3.2663596e-10 ] [ 2.4757783e-10 9.698386e-11 1.6855658e-10 ] [ 2.6315408e-10 2.2726904e-10 -9.09605e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.05e-05 -2e-07 1.52e-05 ] [ -1.2e-06 1.87e-05 -8.2e-06 ] [ -9.8e-06 -8.25e-05 1.9e-05 ] [ 5.22e-05 1.48e-05 -2.24e-05 ] [ -9.02e-05 4.14e-05 -4.52e-05 ] [ 3.85e-05 7.8e-06 4.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.68228545184e-14 -3.2043532416e-16 2.435308463616e-14 ] [ -1.92261194496e-15 2.996070280896e-14 -1.313784829056e-14 ] [ -1.570133088384e-14 -1.32179571216e-13 3.04413557952e-14 ] [ 8.363361960576001e-14 2.371221398784e-14 -3.588875630592e-14 ] [ -1.4451633119616e-13 6.633011210111999e-14 -7.241838326016e-14 ] [ 6.16837999008e-14 1.249697764224e-14 6.665054742528e-14 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }