{ "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" [ [ 2.91343 2.805447 1.311156 ] [ 2.653002 2.505168 3.277079 ] [ 1.829519 4.618852 2.376516 ] [ 4.982305 1.900488 2.423676 ] [ 4.143762 3.996307 2.985709 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.91343e-10 2.805447e-10 1.311156e-10 ] [ 2.653002e-10 2.505168e-10 3.277079e-10 ] [ 1.829519e-10 4.618852000000001e-10 2.376516e-10 ] [ 4.982305e-10 1.900488e-10 2.423676e-10 ] [ 4.143762e-10 3.996307e-10 2.985709e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3973359 -4.4585653 -18.4541664 ] [ -9.5724954 -10.7987317 14.0328358 ] [ -10.7294682 11.7773646 -0.6999655 ] [ 12.1023236 -9.6027669 -0.919164 ] [ 11.5969759 13.0826993 6.0404601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.443132151984527e-09 -7.143409085970139e-09 -2.95668339624329e-08 ] [ -1.533682833259554e-08 -1.730147546403184e-08 2.248308144228527e-08 ] [ -1.719050310365706e-08 1.886941821675755e-08 -1.121468359466582e-09 ] [ 1.939005992927609e-08 -1.538532862217209e-08 -1.472663071481011e-09 ] [ 1.858040365896104e-08 2.096079495541653e-08 9.67788395109523e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 53.507501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.572846713963262e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5175166 2.2831534 -0.7908668 ] [ 1.6740649 1.3762284 4.7321424 ] [ 0.2099971 6.1817188 2.3409889 ] [ 6.6222131 0.3900425 2.3578525 ] [ 5.4982262 5.5951188 3.734019 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5175166e-10 2.2831534e-10 -7.908668e-11 ] [ 1.6740649e-10 1.3762284e-10 4.7321424e-10 ] [ 2.099971e-11 6.181718799999999e-10 2.3409889e-10 ] [ 6.6222131e-10 3.900425000000001e-11 2.3578525e-10 ] [ 5.498226200000001e-10 5.5951188e-10 3.734019e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }