{ "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" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.6921637 -11.7456631 -5.5063657 ] [ -6.7469854 3.684811 -9.0923985 ] [ -7.8361429 -0.8008331 8.8209646 ] [ 4.9103165 -1.2058847 -1.7887905 ] [ 4.5151197 -2.7942544 5.8063761 ] [ 4.4136457 1.5854933 -3.5350934 ] [ 7.4362101 11.276331 5.2953075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.072202822270643e-08 -1.881862681461325e-08 -8.822170390115027e-09 ] [ -1.080986226875894e-08 5.903718036266668e-09 -1.456762830369699e-08 ] [ -1.255488495162791e-08 -1.283076069982788e-09 1.413274325502442e-08 ] [ 7.867194297028484e-09 -1.932040273720421e-09 -2.865958318609142e-09 ] [ 7.234019223453509e-09 -4.476889072247531e-09 9.302840038991884e-09 ] [ 7.071439953034451e-09 2.540240297695041e-09 -5.663843997824383e-09 ] [ 1.191412196957683e-08 1.806667389660229e-08 8.484017876446896e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.6361178 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.621349688034731e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.7416511 1.7909291 2.7179897 ] [ 1.7966217 3.8783144 1.5741276 ] [ 1.5778265 2.3036134 5.0372436 ] [ 4.1658257 1.8659731 2.9052714 ] [ 3.9148215 2.7415572 5.1608629 ] [ 4.1103306 4.1486249 2.0663649 ] [ 4.2286958 4.9421738 4.3079899 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7416511e-10 1.7909291e-10 2.7179897e-10 ] [ 1.7966217e-10 3.8783144e-10 1.5741276e-10 ] [ 1.5778265e-10 2.3036134e-10 5.0372436e-10 ] [ 4.1658257e-10 1.8659731e-10 2.9052714e-10 ] [ 3.9148215e-10 2.7415572e-10 5.160862899999999e-10 ] [ 4.1103306e-10 4.1486249e-10 2.0663649e-10 ] [ 4.2286958e-10 4.9421738e-10 4.3079899e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.7e-06 1.69e-05 1.41e-05 ] [ -6.1e-06 -5.9e-06 -1.62e-05 ] [ -3.1e-06 -0.0 2.3e-06 ] [ 1.71e-05 -6.8e-06 -9.8e-06 ] [ 4.2e-06 -4e-06 -3.2e-06 ] [ 2.9e-06 -2.9e-06 2.3e-06 ] [ -7.4e-06 2.7e-06 1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.233675998016e-14 2.707678489152e-14 2.259069035328e-14 ] [ -9.77327738688e-15 -9.45284206272e-15 -2.595526125696e-14 ] [ -4.96674752448e-15 0.0 3.68500622784e-15 ] [ 2.739722021568e-14 -1.089480102144e-14 -1.570133088384e-14 ] [ 6.72914180736e-15 -6.4087064832e-15 -5.126965186560001e-15 ] [ 4.646312200320001e-15 -4.646312200320001e-15 3.68500622784e-15 ] [ -1.185610699392e-14 4.32587687616e-15 1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.040115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929039076474339e-18 } }