{ "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" [ [ 0.6977917 0.2559248 0.8783031 ] [ 0.349385 0.3940236 2.698898 ] [ 1.248694 1.36901 2.090768 ] [ 0.3246804 2.316928 0.2892628 ] [ 2.775341 0.8800459 0.0497676 ] [ 2.033969 2.77175 0.0650166 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.977917e-11 2.559248e-11 8.783031e-11 ] [ 3.49385e-11 3.940236e-11 2.698898e-10 ] [ 1.248694e-10 1.36901e-10 2.090768e-10 ] [ 3.246804e-11 2.316928e-10 2.892628e-11 ] [ 2.775341e-10 8.800459e-11 4.976760000000001e-12 ] [ 2.033969e-10 2.77175e-10 6.50166e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5277432 -26.3547352 -43.3695826 ] [ -15.5271032 -8.4534631 37.4033764 ] [ 20.0087183 23.1949394 12.8793411 ] [ -19.9371044 9.1463157 -5.4634849 ] [ 5.2304871 -5.042084 -0.4344679 ] [ 11.7527454 7.5090271 -1.0151821 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.447714437626179e-09 -4.222494058481482e-08 -6.948573129557448e-08 ] [ -2.487716173578887e-08 -1.354394094361549e-08 5.992681520706247e-08 ] [ 3.205750067243313e-08 3.716238962755278e-08 2.063497920172856e-08 ] [ -3.194276255612881e-08 1.465401318099599e-08 -8.753467774873827e-09 ] [ 8.380164147015994e-09 -8.078309104909748e-09 -6.960943118680724e-10 ] [ 1.882997391009475e-08 1.203078766457363e-08 -1.626501026474648e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 21.286176220918062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.410421388738382e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4819941 0.0731996 0.5976466 ] [ 0.3881444 0.0663941 2.9315916 ] [ 1.4997067 1.8157316 1.9480848 ] [ -0.0046902 2.3854987 0.1967184 ] [ 2.7835194 0.6740377 0.3038596 ] [ 2.2811867 2.9728205 0.0941151 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.819941e-11 7.31996e-12 5.976466000000001e-11 ] [ 3.881444e-11 6.63941e-12 2.9315916e-10 ] [ 1.4997067e-10 1.8157316e-10 1.9480848e-10 ] [ -4.690200000000001e-13 2.3854987e-10 1.967184e-11 ] [ 2.7835194e-10 6.740377e-11 3.038596e-11 ] [ 2.2811867e-10 2.9728205e-10 9.411509999999999e-12 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-05 8.3e-06 9.9e-06 ] [ 4.2e-06 1.31e-05 -2.49e-05 ] [ 2.6e-06 2.03e-05 2.03e-05 ] [ -2.44e-05 -2.43e-05 -7e-06 ] [ -1.81e-05 -5.3e-06 -2.24e-05 ] [ 2.07e-05 -1.22e-05 2.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-14 1.329806595264e-14 1.586154854592e-14 ] [ 6.72914180736e-15 2.098851373248e-14 -3.989419785791999e-14 ] [ 4.16565921408e-15 3.252418540224e-14 3.252418540224e-14 ] [ -3.909310954752e-14 -3.893289188544e-14 -1.12152363456e-14 ] [ -2.899939683648e-14 -8.491536090240001e-15 -3.588875630592e-14 ] [ 3.316505605055999e-14 -1.954655477376e-14 3.84522388992e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.374875279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.021367613266096e-18 } }