{ "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" [ [ -2.110795 3.1732463 -5.4670851 ] [ -1.5572668 -2.6109142 5.4679078 ] [ 4.0259259 0.7502503 -0.1512673 ] [ 1.0538274 -0.8103585 -3.4138 ] [ -1.4116915 -0.5022239 3.5642446 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.381866400301536e-09 5.084101033900103e-09 -8.759235931144032e-09 ] [ -2.495016459308029e-09 -4.183145690154735e-09 8.760554041849962e-09 ] [ 6.450244354053199e-09 1.202033490408186e-09 -2.423569315515398e-10 ] [ 1.68841762263845e-09 -1.298337443166557e-09 -5.46951054808704e-09 ] [ -2.261779117082083e-09 -8.046513909869971e-10 5.710549368932647e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.227567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.119289859746559e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5601343 1.5828118 0.8889405 ] [ 1.329363 0.2796729 2.7337977 ] [ 3.5828981 0.854032 2.1998759 ] [ 2.8136692 2.1571721 0.3550203 ] [ 1.9570445 2.6556664 2.6073561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.601343e-11 1.5828118e-10 8.889405e-11 ] [ 1.329363e-10 2.796729e-11 2.733797700000001e-10 ] [ 3.5828981e-10 8.540320000000001e-11 2.1998759e-10 ] [ 2.8136692e-10 2.1571721e-10 3.550203e-11 ] [ 1.9570445e-10 2.6556664e-10 2.6073561e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 -7e-07 4.3e-06 ] [ -1.2e-06 -4e-06 -5e-07 ] [ -4.1e-06 8e-07 7e-07 ] [ 2.2e-06 1e-06 -5.5e-06 ] [ -2e-07 3e-06 1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 -1.12152363456e-15 6.889359469440001e-15 ] [ -1.92261194496e-15 -6.4087064832e-15 -8.010883104e-16 ] [ -6.568924145279999e-15 1.28174129664e-15 1.12152363456e-15 ] [ 3.52478856576e-15 1.6021766208e-15 -8.8119714144e-15 ] [ -3.2043532416e-16 4.8065298624e-15 1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }