{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8189887 -6.5624463 3.5666899 ] [ -2.126744 -0.5184228 -2.8754862 ] [ -3.1613368 6.939831 1.3536803 ] [ -2.6674933 0.8302583 0.6241447 ] [ 1.347612 -1.5365852 -0.7191893 ] [ 4.259427 -0.4039143 -7.3232491 ] [ 4.1675238 1.2512795 5.3734097 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.914341168639385e-09 -1.051419803711546e-08 5.71446717142349e-09 ] [ -3.407419515226675e-09 -8.306048898496742e-10 -4.607036763073033e-09 ] [ -5.065019911434686e-09 1.111883498050309e-08 2.16883492869753e-09 ] [ -4.273795401400641e-09 1.330220437485153e-09 9.999900463362297e-10 ] [ 2.15911244030953e-09 -2.461880883307292e-09 -1.152268282389518e-09 ] [ 6.824354357404281e-09 -6.471420482667974e-10 -1.173313849631464e-08 ] [ 6.677109198987575e-09 2.004770760986314e-09 8.609151395319943e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.443393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474304321042638e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7178316 1.7582772 4.2854377 ] [ 1.624402 3.1520396 1.1287646 ] [ 3.1843476 4.9941729 3.2305959 ] [ 1.2530191 3.4452546 3.4415069 ] [ 4.6697857 1.9475828 2.6707713 ] [ 3.9171098 3.7036659 1.2377848 ] [ 4.4735974 3.5127971 4.6153789 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7178316e-10 1.7582772e-10 4.2854377e-10 ] [ 1.624402e-10 3.1520396e-10 1.1287646e-10 ] [ 3.1843476e-10 4.994172899999999e-10 3.2305959e-10 ] [ 1.2530191e-10 3.4452546e-10 3.4415069e-10 ] [ 4.6697857e-10 1.9475828e-10 2.6707713e-10 ] [ 3.9171098e-10 3.7036659e-10 1.2377848e-10 ] [ 4.4735974e-10 3.5127971e-10 4.6153789e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.5e-06 -6.29e-05 7.2e-06 ] [ -3.8e-06 3e-07 -1.75e-05 ] [ -1.5e-05 4.86e-05 1e-05 ] [ 2.52e-05 1.24e-05 1.36e-05 ] [ -2.32e-05 -2.51e-05 -1.08e-05 ] [ 1.4e-05 -8.9e-06 -4.01e-05 ] [ -2.6e-06 3.56e-05 3.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.8119714144e-15 -1.0077690944832e-13 1.153567166976e-14 ] [ -6.08827115904e-15 4.8065298624e-16 -2.8038090864e-14 ] [ -2.4032649312e-14 7.786578377088e-14 1.6021766208e-14 ] [ 4.037485084416e-14 1.986699009792e-14 2.178960204288e-14 ] [ -3.717049760256e-14 -4.021463318208e-14 -1.730350750464e-14 ] [ 2.24304726912e-14 -1.425937192512e-14 -6.424728249408e-14 ] [ -4.16565921408e-15 5.703748770048e-14 6.008162327999999e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.439394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.11453425893198e-18 } }