{ "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" [ [ 2.376748 2.356906 1.723048 ] [ 1.891208 1.427855 3.861744 ] [ 2.621896 4.609245 2.418974 ] [ 4.560356 2.199202 1.122098 ] [ 4.097908 2.987714 3.135416 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.376748e-10 2.356906e-10 1.723048e-10 ] [ 1.891208e-10 1.427855e-10 3.861744e-10 ] [ 2.621896e-10 4.609245e-10 2.418974e-10 ] [ 4.560356e-10 2.199202e-10 1.122098e-10 ] [ 4.097908e-10 2.987714e-10 3.135416e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.237567 -0.5220203 -0.8658314 ] [ 3.445483 2.1156898 -1.2484749 ] [ -0.6885543 1.1617626 -0.1148667 ] [ 2.1076645 -1.3528603 -2.3563544 ] [ -1.6270261 -1.4025718 4.5855275 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.187154198409477e-09 -8.363687271336702e-10 -1.387214838063508e-09 ] [ 5.520272355444221e-09 3.389708762352133e-09 -2.000277312915486e-09 ] [ -1.103185610700226e-09 1.861348891975088e-09 -1.840367427646878e-10 ] [ 3.376850814211293e-09 -2.16752116172623e-09 -3.775295961103089e-09 ] [ -2.606783200328147e-09 -2.247167765467321e-09 7.346825015064435e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.949765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.914563426479101e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2270276 2.4597446 1.5914446 ] [ 2.1971639 1.4322778 3.7702886 ] [ 2.5733281 4.6983408 2.4116296 ] [ 4.5583778 2.017935 1.17485 ] [ 3.9922186 2.9726238 3.3130671 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2270276e-10 2.4597446e-10 1.5914446e-10 ] [ 2.1971639e-10 1.4322778e-10 3.7702886e-10 ] [ 2.5733281e-10 4.698340800000001e-10 2.4116296e-10 ] [ 4.5583778e-10 2.017935e-10 1.17485e-10 ] [ 3.9922186e-10 2.9726238e-10 3.3130671e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-06 7e-07 3e-06 ] [ 2e-07 9e-07 -3.4e-06 ] [ -1e-07 -2.8e-06 -7e-07 ] [ -3e-06 1e-07 1.1e-06 ] [ 6e-07 1.1e-06 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.685006258199999e-15 1.1215236438e-15 4.806529901999999e-15 ] [ 3.204353268e-16 1.4419589706e-15 -5.4474005556e-15 ] [ -1.602176634e-16 -4.486094575199999e-15 -1.1215236438e-15 ] [ -4.806529901999999e-15 1.602176634e-16 1.7623942974e-15 ] [ 9.613059803999998e-16 1.7623942974e-15 0.0 ] ] } "relaxed-potential-energy" { "source-value" -13.21532 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.117327691483288e-18 } }