{ "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" [ [ 0.3527209 0.4565602 1.167471 ] [ 0.6414148 2.926013 0.4472085 ] [ 0.2560781 2.125953 2.651252 ] [ 2.793307 0.1807352 2.367537 ] [ 2.546309 2.149048 0.8335699 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.527209e-11 4.565602e-11 1.167471e-10 ] [ 6.414148e-11 2.926013000000001e-10 4.472085e-11 ] [ 2.560781e-11 2.125953e-10 2.651252e-10 ] [ 2.793307e-10 1.807352e-11 2.367537e-10 ] [ 2.546309e-10 2.149048e-10 8.335699e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.5748452 -3.4609948 0.7468487 ] [ -1.9206081 3.9980686 -3.0458217 ] [ -2.0716023 1.0429115 4.6159015 ] [ -3.6833376 1.9234893 -2.9888821 ] [ 3.1007029 -3.5034745 0.6719536 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.329710023219102e-09 -5.545124953270371e-09 1.196583526414873e-09 ] [ -3.077153395539108e-09 6.405612039274587e-09 -4.879944318865311e-09 ] [ -3.319072772655507e-09 1.670928422863459e-09 7.395489467215651e-09 ] [ -5.901357389233583e-09 3.081769586818958e-09 -4.788717022947608e-09 ] [ 4.96787369442676e-09 -5.613184935468969e-09 1.076588348182395e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.73737 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.04075164244793e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6936458 0.5403647 1.6437853 ] [ 0.7615346 3.0958897 0.7705937 ] [ -0.6581635 2.3381555 2.5253643 ] [ 3.0231502 0.0280983 2.0279883 ] [ 2.7696627 1.8358013 0.4993068 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.936458e-11 5.403647000000001e-11 1.6437853e-10 ] [ 7.615346e-11 3.0958897e-10 7.705937e-11 ] [ -6.581635e-11 2.3381555e-10 2.5253643e-10 ] [ 3.0231502e-10 2.80983e-12 2.0279883e-10 ] [ 2.7696627e-10 1.8358013e-10 4.993068e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.87e-05 -6.72e-05 3.54e-05 ] [ -5e-06 7.38e-05 -1.88e-05 ] [ -5.7e-05 2.36e-05 7.5e-06 ] [ 1.93e-05 -1.66e-05 -1.73e-05 ] [ 2.39e-05 -1.36e-05 -6.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.996070280896e-14 -1.0766626891776e-13 5.671705237632e-14 ] [ -8.010883104e-15 1.1824063461504e-13 -3.012092047104e-14 ] [ -9.13240673856e-14 3.781136825088e-14 1.2016324656e-14 ] [ 3.092200878144e-14 -2.659613190528e-14 -2.771765553984e-14 ] [ 3.829202123712e-14 -2.178960204288e-14 -1.089480102144e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.036401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.409097014317374e-18 } }