{ "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" [ [ -2.436427 -2.284833 -6.1629721 ] [ -5.5090717 -0.1586479 -0.4734783 ] [ -3.3521727 4.5461177 2.4546765 ] [ 0.9161353 -2.2343175 -0.3155353 ] [ 3.9247445 -3.4932149 1.7714602 ] [ 6.2846274 3.68775 1.0868443 ] [ 0.1721642 -0.0628545 1.6390046 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.903586377685882e-09 -3.660706015032326e-09 -9.87416981326268e-09 ] [ -8.826505880050912e-09 -2.541819563190163e-10 -7.585958627161287e-10 ] [ -5.370772728824013e-09 7.283683494345068e-09 3.932825299927172e-09 ] [ 1.467810559149594e-09 -3.579771261944304e-09 -5.055432806971142e-10 ] [ 6.288133880513386e-09 -5.596747244210211e-09 2.838192117117692e-09 ] [ 1.006908309071909e-08 5.9084268333552e-09 1.741316527909742e-09 ] [ 2.758374561787354e-10 -1.007040104120736e-10 2.625974851503656e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.782128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.047922664567306e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6870309 2.9725872 1.4347681 ] [ 1.1100577 1.6521604 2.9975638 ] [ 1.5667119 4.0675224 3.4887299 ] [ 4.4664486 1.2079767 2.0613252 ] [ 3.1844361 1.0598101 4.1254117 ] [ 4.9230888 3.6233421 2.5524724 ] [ 3.6308509 3.420991 4.6055519 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6870309e-10 2.9725872e-10 1.4347681e-10 ] [ 1.1100577e-10 1.6521604e-10 2.9975638e-10 ] [ 1.5667119e-10 4.0675224e-10 3.4887299e-10 ] [ 4.4664486e-10 1.2079767e-10 2.0613252e-10 ] [ 3.1844361e-10 1.0598101e-10 4.1254117e-10 ] [ 4.923088800000001e-10 3.6233421e-10 2.5524724e-10 ] [ 3.6308509e-10 3.420991e-10 4.6055519e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.5e-06 6.8e-06 -6.9e-06 ] [ -7e-07 -1e-06 2.38e-05 ] [ 7.8e-06 -2.12e-05 -1.7e-05 ] [ -1.64e-05 3.2e-06 -5.3e-06 ] [ 0.0 3e-06 -5.9e-06 ] [ 2.56e-05 7.3e-06 1.75e-05 ] [ -9.7e-06 1.9e-06 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.04141480352e-14 1.089480102144e-14 -1.105501868352e-14 ] [ -1.12152363456e-15 -1.6021766208e-15 3.813180357504e-14 ] [ 1.249697764224e-14 -3.396614436096001e-14 -2.72370025536e-14 ] [ -2.627569658112e-14 5.126965186560001e-15 -8.491536090240001e-15 ] [ 0.0 4.8065298624e-15 -9.45284206272e-15 ] [ 4.101572149248001e-14 1.169588933184e-14 2.8038090864e-14 ] [ -1.554111322176e-14 3.04413557952e-15 -9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.72791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.840324293764653e-18 } }