{ "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" [ [ 1.891577 1.147444 4.176951 ] [ 1.947528 5.315412 2.001915 ] [ 3.037668 3.274696 0.9821769 ] [ 1.344392 3.383525 2.90788 ] [ 3.679276 1.837825 2.704146 ] [ 4.016034 4.351153 3.141989 ] [ 3.129852 3.103182 4.716137 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.891577e-10 1.147444e-10 4.176951e-10 ] [ 1.947528e-10 5.315412000000001e-10 2.001915e-10 ] [ 3.037668e-10 3.274696e-10 9.821769000000001e-11 ] [ 1.344392e-10 3.383525e-10 2.90788e-10 ] [ 3.679276000000001e-10 1.837825e-10 2.704146e-10 ] [ 4.016034e-10 4.351153e-10 3.141989e-10 ] [ 3.129852e-10 3.103182e-10 4.716137e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9400132 -0.2815248 -0.3168156 ] [ 1.530368 2.6120208 -1.4474658 ] [ -0.5509619 1.4085211 -0.938567 ] [ -0.0159421 -3.5711851 1.7101574 ] [ 0.7460072 -1.0618888 0.2339126 ] [ 0.4149132 2.0035666 -3.3629803 ] [ -1.1843711 -1.1095098 4.1217588 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.506067184691568e-09 -4.510524564515232e-10 -5.075945516066903e-10 ] [ 2.451919851021312e-09 4.184918693281986e-09 -2.319095883274117e-09 ] [ -8.827382824042446e-10 2.256699594915977e-09 -1.503750116843478e-09 ] [ -2.55420601168914e-11 -5.721669322908953e-09 2.739974226742191e-09 ] [ 1.195235304635765e-09 -1.701333423266299e-09 3.747693021181884e-10 ] [ 6.647642341781688e-10 3.210067591182824e-09 -5.388088457262309e-09 ] [ -1.897571702404877e-09 -1.777630676754013e-09 6.603785640343879e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.212717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.238434288705458e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8166576 1.0809096 4.1460787 ] [ 2.0246969 5.4414323 1.8279428 ] [ 2.9530637 3.35294 0.8967677 ] [ 1.496417 3.2925947 3.0080436 ] [ 3.7121223 1.8508151 2.7514918 ] [ 3.9143604 4.391126 3.0347687 ] [ 3.1290091 3.0034194 4.9661015 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8166576e-10 1.0809096e-10 4.146078700000001e-10 ] [ 2.0246969e-10 5.4414323e-10 1.8279428e-10 ] [ 2.9530637e-10 3.35294e-10 8.967677e-11 ] [ 1.496417e-10 3.2925947e-10 3.0080436e-10 ] [ 3.7121223e-10 1.8508151e-10 2.7514918e-10 ] [ 3.9143604e-10 4.391126e-10 3.0347687e-10 ] [ 3.1290091e-10 3.0034194e-10 4.9661015e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.4e-06 5e-07 9e-07 ] [ -2.5e-06 1.37e-05 -2.32e-05 ] [ -0.0 -7.7e-06 -1.85e-05 ] [ -6e-07 6.4e-06 2.63e-05 ] [ -8e-07 3.74e-05 1.8e-05 ] [ -8.4e-06 -3.82e-05 3.21e-05 ] [ 4e-06 -1.21e-05 -3.57e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.34582837256e-14 8.010883169999999e-16 1.4419589706e-15 ] [ -4.005441585e-15 2.19498198858e-14 -3.71704979088e-14 ] [ 0.0 -1.23367600818e-14 -2.9640267729e-14 ] [ -9.613059803999998e-16 1.02539304576e-14 4.21372454742e-14 ] [ -1.2817413072e-15 5.99214061116e-14 2.8839179412e-14 ] [ -1.34582837256e-14 -6.12031474188e-14 5.14298699514e-14 ] [ 6.408706535999999e-15 -1.93863372714e-14 -5.719770583379999e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.591051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.459267741570233e-18 } }