{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1397048 -0.1911085 0.2279037 ] [ 0.1971004 -0.0419734 -0.1771964 ] [ -0.2954919 -0.6652898 0.3165589 ] [ -0.6815585 0.7949387 -0.3654962 ] [ 0.6402453 0.103433 -0.0017699 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.238317662176432e-10 -3.06189573258789e-10 3.651419829421457e-10 ] [ 3.157896554320536e-10 -6.724880072953559e-11 -2.838999317089176e-10 ] [ -4.734302177162645e-10 -1.065911772398533e-09 5.071832728647426e-10 ] [ -1.091977103404089e-09 1.273632210602336e-09 -5.855894714557908e-10 ] [ 1.02578605968832e-09 1.65717935784522e-10 -2.8356924245166e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -13.657095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.188107849731823e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1457666 2.5491804 1.6058996 ] [ 1.9389945 1.8386984 3.9360391 ] [ 1.7114455 4.809602 2.4298596 ] [ 0.1869461 3.0885526 2.965744 ] [ 3.4634948 3.5597496 3.4001627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1457666e-10 2.5491804e-10 1.6058996e-10 ] [ 1.9389945e-10 1.8386984e-10 3.9360391e-10 ] [ 1.7114455e-10 4.809602e-10 2.4298596e-10 ] [ 1.869461e-11 3.0885526e-10 2.965744e-10 ] [ 3.4634948e-10 3.5597496e-10 3.4001627e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.05e-05 5.4e-06 2.58e-05 ] [ -9e-07 -1.12e-05 -5.9e-06 ] [ 7.5e-06 7.4e-06 -6e-06 ] [ -4.29e-05 -1.37e-05 -1.35e-05 ] [ 4.68e-05 1.2e-05 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6822854657e-14 8.6517538236e-15 4.133615715719999e-14 ] [ -1.4419589706e-15 -1.79443783008e-14 -9.452842140600001e-15 ] [ 1.2016324755e-14 1.18561070916e-14 -9.613059803999999e-15 ] [ -6.873337759859999e-14 -2.19498198858e-14 -2.162938455899999e-14 ] [ 7.498186647119999e-14 1.9226119608e-14 -6.408706536e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971627206706e-18 } }