{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3189122 -3.4933246 -0.4820456 ] [ -1.8354412 2.5187277 -0.265555 ] [ -2.6818944 3.1659493 0.4619975 ] [ 1.8331769 -2.6376532 1.2286717 ] [ -1.280108 1.2061387 -0.7079327 ] [ 3.6137323 0.5583372 -1.2367092 ] [ 0.6694466 -1.3181751 1.0015733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.109536709278938e-10 -5.596923002985511e-09 -7.723221904795084e-10 ] [ -2.940700979493097e-09 4.035446635101356e-09 -4.25466012536544e-10 ] [ -4.296868507134443e-09 5.072409951098125e-09 7.402015933680481e-10 ] [ 2.937073170970619e-09 -4.225986290818307e-09 1.968549072378591e-09 ] [ -2.050959109699047e-09 1.932447226582105e-09 -1.13423322103982e-09 ] [ 5.789837404889812e-09 8.945548083629337e-10 -1.981426566968271e-09 ] [ 1.072571691394049e-09 -2.111949327340702e-09 1.604697325277505e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.58255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.618123364804705e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9233591 1.8633909 3.1023914 ] [ 3.2352599 3.9011113 0.9254687 ] [ 2.1367717 4.24971 3.0272559 ] [ 3.4390769 1.586978 1.3196129 ] [ 5.1616555 2.1042029 2.8418825 ] [ 4.5906438 4.4321854 2.8298298 ] [ 3.59652 2.8880746 4.4794421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9233591e-10 1.8633909e-10 3.1023914e-10 ] [ 3.2352599e-10 3.9011113e-10 9.254687000000001e-11 ] [ 2.1367717e-10 4.24971e-10 3.0272559e-10 ] [ 3.4390769e-10 1.586978e-10 1.3196129e-10 ] [ 5.1616555e-10 2.1042029e-10 2.8418825e-10 ] [ 4.5906438e-10 4.4321854e-10 2.8298298e-10 ] [ 3.59652e-10 2.8880746e-10 4.4794421e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.1e-06 -3.2e-06 1.23e-05 ] [ -2.5e-06 2.4e-06 -1.47e-05 ] [ -1.64e-05 -8.5e-06 -1.27e-05 ] [ -1e-06 2.28e-05 2.12e-05 ] [ 5.6e-06 -7e-07 1e-07 ] [ 2.22e-05 3.6e-06 2.4e-06 ] [ 1.2e-06 -1.64e-05 -8.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.457980724928e-14 -5.126965186560001e-15 1.970677243584e-14 ] [ -4.005441552e-15 3.84522388992e-15 -2.355199632576e-14 ] [ -2.627569658112e-14 -1.36185012768e-14 -2.034764308416e-14 ] [ -1.6021766208e-15 3.652962695424e-14 3.396614436096001e-14 ] [ 8.972189076479999e-15 -1.12152363456e-15 1.6021766208e-16 ] [ 3.556832098176e-14 5.76783583488e-15 3.84522388992e-15 ] [ 1.92261194496e-15 -2.627569658112e-14 -1.377871893888e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }