{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -20.3745168 -3.1836594 -16.6346282 ] [ -9.7139075 -12.6398911 16.1809866 ] [ 21.6028787 -12.1442663 4.1990229 ] [ 7.2111746 10.4147694 -13.7733096 ] [ 1.274371 17.5530473 10.0279282 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.264357447705683e-08 -5.100784659270156e-09 -2.665161239774039e-08 ] [ -1.556339549311377e-08 -2.025133800987799e-08 2.592479843199808e-08 ] [ 3.46116271951183e-08 -1.945725954262932e-08 6.727576320583816e-09 ] [ 1.155357535262679e-08 1.668630004370324e-08 -2.20672746321602e-08 ] [ 2.041767422425517e-09 2.812308200785656e-08 1.606651211710103e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.7845007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.567649826774124e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5363118 1.0487017 0.5294033 ] [ 1.254117 -0.2242008 2.3723915 ] [ 3.0699016 0.8937981 3.3649273 ] [ 1.9084667 2.9533961 0.382909 ] [ 3.474312 2.8576602 2.1353595 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.363118e-11 1.0487017e-10 5.294033e-11 ] [ 1.254117e-10 -2.242008e-11 2.3723915e-10 ] [ 3.0699016e-10 8.937981000000001e-11 3.3649273e-10 ] [ 1.9084667e-10 2.9533961e-10 3.82909e-11 ] [ 3.474312e-10 2.8576602e-10 2.1353595e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.7e-06 -2.6e-06 -4.9e-06 ] [ -3e-06 1.32e-05 -1.44e-05 ] [ 1.51e-05 2.4e-05 -4.2e-06 ] [ -1.31e-05 -1.39e-05 -2.3e-06 ] [ 7.7e-06 -2.07e-05 2.58e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.073458335936e-14 -4.16565921408e-15 -7.850665441919999e-15 ] [ -4.8065298624e-15 2.114873139456e-14 -2.307134333952e-14 ] [ 2.419286697408e-14 3.84522388992e-14 -6.72914180736e-15 ] [ -2.098851373248e-14 -2.227025502912e-14 -3.68500622784e-15 ] [ 1.233675998016e-14 -3.316505605055999e-14 4.133615681664e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }