{ "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" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2810489 6.8597819 -27.3952331 ] [ -13.0566615 -8.2191592 3.5263809 ] [ -16.2851972 19.853242 1.3088327 ] [ 9.146838 -9.3232587 -9.9812627 ] [ 3.6212434 -26.0514184 20.4401003 ] [ 24.0743673 9.8768644 1.3247584 ] [ 1.780459 7.0039481 10.7764236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.486987956408156e-08 1.0990582183967e-08 -4.38920019941863e-08 ] [ -2.091907780099946e-08 -1.316854471287323e-08 5.649885034015663e-09 ] [ -2.609176221895762e-08 3.180840017948464e-08 2.09698115247854e-09 ] [ 1.465484999784503e-08 -1.49375071188102e-08 -1.599174574400309e-08 ] [ 5.801871513706303e-09 -4.173897349915894e-08 3.274865082746707e-08 ] [ 3.857138844861201e-08 1.582448122849182e-08 2.122496936688414e-09 ] [ 2.852609784092947e-09 1.122156189911658e-08 1.726573394775737e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.1753698 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.470056298075437e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6154349 3.0400619 1.0276646 ] [ 1.2069335 1.6106437 4.0858031 ] [ 1.6378819 3.7049424 3.0749532 ] [ 4.2898458 1.6750155 1.9879108 ] [ 2.9948447 0.2421499 3.3530126 ] [ 5.3057798 3.181547 3.5017955 ] [ 3.5179044 4.5500295 4.2346832 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6154349e-10 3.0400619e-10 1.0276646e-10 ] [ 1.2069335e-10 1.6106437e-10 4.0858031e-10 ] [ 1.6378819e-10 3.7049424e-10 3.0749532e-10 ] [ 4.2898458e-10 1.6750155e-10 1.9879108e-10 ] [ 2.9948447e-10 2.421499e-11 3.3530126e-10 ] [ 5.3057798e-10 3.181547e-10 3.5017955e-10 ] [ 3.5179044e-10 4.5500295e-10 4.234683200000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.5e-06 -1.93e-05 -1.52e-05 ] [ 3.53e-05 -4e-07 1.41e-05 ] [ -6e-07 -9e-06 1.88e-05 ] [ -1.44e-05 -4e-06 3.12e-05 ] [ -3.37e-05 2.46e-05 -4.82e-05 ] [ 3.7e-05 8.9e-06 2.23e-05 ] [ -2.21e-05 -8e-07 -2.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4032649312e-15 -3.092200878144e-14 -2.435308463616e-14 ] [ 5.655683471424e-14 -6.408706483200001e-16 2.259069035328e-14 ] [ -9.6130597248e-16 -1.44195895872e-14 3.012092047104e-14 ] [ -2.307134333952e-14 -6.4087064832e-15 4.998791056896e-14 ] [ -5.399335212096e-14 3.941354487168e-14 -7.722491312256001e-14 ] [ 5.92805349696e-14 1.425937192512e-14 3.572853864384e-14 ] [ -3.540810331968e-14 -1.28174129664e-15 -3.68500622784e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }