{ "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" [ [ 2.669584 2.17361 1.86928 ] [ 2.40373 2.157546 4.053208 ] [ 2.652376 4.1548 1.079323 ] [ 1.859138 4.715654 3.12876 ] [ 4.632592 2.488435 2.820091 ] [ 5.239324 3.537857 1.028061 ] [ 3.752209 4.156911 4.495978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.669584e-10 2.17361e-10 1.86928e-10 ] [ 2.40373e-10 2.157546e-10 4.053208e-10 ] [ 2.652376e-10 4.1548e-10 1.079323e-10 ] [ 1.859138e-10 4.715654e-10 3.12876e-10 ] [ 4.632592e-10 2.488435e-10 2.820091e-10 ] [ 5.239324e-10 3.537857e-10 1.028061e-10 ] [ 3.752209000000001e-10 4.156911e-10 4.495978e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7243743 -6.9152053 -3.8984153 ] [ -4.3202126 -2.9431063 4.7109215 ] [ -1.1845176 3.5246145 -3.5697097 ] [ -2.0052226 4.472202 1.3825918 ] [ 7.6729411 -2.3702421 2.2798639 ] [ 2.2962471 2.4590079 -2.3681301 ] [ 1.265139 1.7727293 1.462878 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.967105430568366e-09 -1.107938025969225e-08 -6.245949851829019e-09 ] [ -6.921743624605582e-09 -4.715376106389191e-09 7.547728289724068e-09 ] [ -1.897806405646126e-09 5.647054949232682e-09 -5.719305424382983e-09 ] [ -3.21272076921979e-09 7.165257487895002e-09 2.21515625806979e-09 ] [ 1.229340684319543e-08 -3.797546478255896e-09 3.652744639185909e-09 ] [ 3.6789934191998e-09 3.939764967742504e-09 -3.794162681232766e-09 ] [ 2.026976127862291e-09 2.840225439467149e-09 2.343788930682662e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1628247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.147611027322877e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7521636 1.7242087 1.9894764 ] [ 1.9195473 2.0849149 4.2028155 ] [ 2.5622271 3.9345402 0.9964278 ] [ 2.4552472 5.2082755 2.9856852 ] [ 4.9708779 2.5867204 2.8493085 ] [ 4.9500822 4.0787148 0.9796123 ] [ 3.5988077 3.7674384 4.4713753 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7521636e-10 1.7242087e-10 1.9894764e-10 ] [ 1.9195473e-10 2.0849149e-10 4.2028155e-10 ] [ 2.5622271e-10 3.9345402e-10 9.964278000000001e-11 ] [ 2.4552472e-10 5.2082755e-10 2.9856852e-10 ] [ 4.9708779e-10 2.5867204e-10 2.8493085e-10 ] [ 4.9500822e-10 4.0787148e-10 9.796123e-11 ] [ 3.5988077e-10 3.7674384e-10 4.4713753e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2e-06 5e-07 -7.4e-06 ] [ 3.5e-06 5e-07 -4.9e-06 ] [ -1.32e-05 -9.6e-06 -1.13e-05 ] [ 1.54e-05 -1.7e-06 4.6e-06 ] [ 7.5e-06 -5.2e-06 -1e-06 ] [ -8.4e-06 2.3e-06 1.81e-05 ] [ -2.8e-06 1.32e-05 1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.2043532416e-15 8.010883104e-16 -1.185610699392e-14 ] [ 5.6076181728e-15 8.010883104e-16 -7.850665441919999e-15 ] [ -2.114873139456e-14 -1.538089555968e-14 -1.810459581504e-14 ] [ 2.467351996032e-14 -2.72370025536e-15 7.370012455680001e-15 ] [ 1.2016324656e-14 -8.33131842816e-15 -1.6021766208e-15 ] [ -1.345828361472e-14 3.68500622784e-15 2.899939683648e-14 ] [ -4.48609453824e-15 2.114873139456e-14 3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }