{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9639843 -0.6862923 2.7114832 ] [ -6.2317716 1.7921662 3.8771893 ] [ 8.1310412 -15.2610716 7.4863207 ] [ 17.0425958 4.6421282 1.3150121 ] [ -16.9778809 9.5130696 -15.3900053 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.146649755002846e-09 -1.099561487154118e-09 4.344275026523548e-09 ] [ -9.984398845944793e-09 2.871366809884571e-09 6.211942102054816e-09 ] [ 1.302736422073132e-08 -2.445093232732099e-08 1.199440810017052e-08 ] [ 2.730524877346654e-08 7.437509334072479e-09 2.106881660047271e-09 ] [ -2.720156407281488e-08 1.524161783073572e-08 -2.465750688879616e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.45398364 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.273619802262677e-20 } "relaxed-configuration-positions" { "source-value" [ [ 1.0040881 0.2110426 3.0707356 ] [ 0.5499655 2.2738458 2.069591 ] [ 3.0904015 -0.0271771 2.0089136 ] [ 2.9198684 2.0040885 0.8652884 ] [ 0.8888994 2.5663221 -0.2932291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0040881e-10 2.110426e-11 3.0707356e-10 ] [ 5.499655e-11 2.2738458e-10 2.069591e-10 ] [ 3.0904015e-10 -2.71771e-12 2.0089136e-10 ] [ 2.9198684e-10 2.0040885e-10 8.652884e-11 ] [ 8.888994000000001e-11 2.5663221e-10 -2.932291e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.91e-05 -4.9e-06 -9.84e-05 ] [ 0.0001757 3.54e-05 -9e-06 ] [ 2.13e-05 -0.0001097 9.1e-05 ] [ -0.000192 0.0001942 -7.32e-05 ] [ 5.4e-05 -0.000115 8.97e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.468863906939999e-14 -7.850665506599998e-15 -1.576541807856e-13 ] [ 2.815024345937999e-13 5.671705284359999e-14 -1.4419589706e-14 ] [ 3.41263623042e-14 -1.757587767498e-13 1.45798073694e-13 ] [ -3.07617913728e-13 3.111427023228e-13 -1.172793296088e-13 ] [ 8.651753823599998e-14 -1.8425031291e-13 1.437152440698e-13 ] ] } "relaxed-potential-energy" { "source-value" -14.844323 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.378322745814878e-18 } }