{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1883224 -5.4094104 -3.0596562 ] [ -3.2816253 1.5513677 -5.0676762 ] [ -5.6677399 -0.2645439 6.11448 ] [ -1.2435659 10.2080723 3.8863144 ] [ 12.3812536 -6.0854856 -1.8734619 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.506078988052946e-09 -8.666830875192375e-09 -4.902109631325769e-09 ] [ -5.257743333885786e-09 2.485565059204268e-09 -8.119312329424585e-09 ] [ -9.08072036055533e-09 -4.238460517552531e-10 9.796476904349185e-09 ] [ -1.99241221140411e-09 1.635513478249608e-08 6.226562072758379e-09 ] [ 1.983695505411584e-08 -9.750022754535062e-09 -3.001616856139547e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.53852793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.62816859093819e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.0111969 -0.053254 1.8682302 ] [ 2.0392346 1.7006722 1.0067532 ] [ 1.6188698 0.8798241 3.7748908 ] [ 4.3353023 4.4927563 3.8703054 ] [ 4.5962553 2.7159592 3.3625824 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0111969e-10 -5.325400000000001e-12 1.8682302e-10 ] [ 2.0392346e-10 1.7006722e-10 1.0067532e-10 ] [ 1.6188698e-10 8.798241e-11 3.7748908e-10 ] [ 4.3353023e-10 4.4927563e-10 3.8703054e-10 ] [ 4.5962553e-10 2.7159592e-10 3.3625824e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-05 -2.42e-05 -1.8e-05 ] [ 3.3e-06 4.6e-06 2.01e-05 ] [ 1.17e-05 1.96e-05 -2.1e-06 ] [ -1.5e-06 1.03e-05 2.9e-06 ] [ 1.5e-06 -1.03e-05 -2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-14 -3.877267422336e-14 -2.88391791744e-14 ] [ 5.28718284864e-15 7.370012455680001e-15 3.220375007808e-14 ] [ 1.874546646336e-14 3.140266176767999e-14 -3.36457090368e-15 ] [ -2.4032649312e-15 1.650241919424e-14 4.646312200320001e-15 ] [ 2.4032649312e-15 -1.650241919424e-14 -4.646312200320001e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.135307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065814150723059e-18 } }