{ "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" [ [ 1.256228 0.2353278 1.625271 ] [ 0.7175946 2.735818 1.079118 ] [ 2.902295 0.4260222 2.532348 ] [ 1.615511 1.481432 2.901286 ] [ 2.936652 2.941975 2.695922 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.256228e-10 2.353278e-11 1.625271e-10 ] [ 7.175946e-11 2.735818e-10 1.079118e-10 ] [ 2.902295e-10 4.260222e-11 2.532348e-10 ] [ 1.615511e-10 1.481432e-10 2.901286e-10 ] [ 2.936652e-10 2.941975e-10 2.695922e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.981036 -10.6245071 -12.9266101 ] [ -2.2687203 2.6209385 -2.8881521 ] [ 20.113132 -12.8514187 0.7836686 ] [ -13.1737882 12.3825925 14.9456884 ] [ 5.3104126 8.4723948 0.0854052 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.599138253056315e-08 -1.702233688314361e-08 -2.071071248841715e-08 ] [ -3.634890623794362e-09 4.199206389254621e-09 -4.627329771934423e-09 ] [ 3.222478986146435e-08 -2.059024258525193e-08 1.255575509375067e-09 ] [ -2.110673546141091e-08 1.983910020839342e-08 2.394563253624176e-08 ] [ 8.508218914521742e-09 1.357427287074749e-08 1.368342147347482e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 5.943727 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.522900439817723e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4827573 0.2632483 0.8311859 ] [ 0.0910215 1.8505069 1.5873963 ] [ 3.431285 0.4737457 1.9207295 ] [ 1.179405 3.0419696 3.1443216 ] [ 3.2438119 2.1911045 3.3503118 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4827573e-10 2.632483e-11 8.311859e-11 ] [ 9.102150000000002e-12 1.8505069e-10 1.5873963e-10 ] [ 3.431285e-10 4.737457e-11 1.9207295e-10 ] [ 1.179405e-10 3.0419696e-10 3.1443216e-10 ] [ 3.2438119e-10 2.1911045e-10 3.3503118e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.4e-06 -9.9e-06 -9.7e-06 ] [ 1.3e-06 6.4e-06 7.6e-06 ] [ 9.4e-06 -7e-06 -2.6e-06 ] [ -6e-07 5e-06 2.3e-06 ] [ -8.7e-06 5.5e-06 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.24304726912e-15 -1.586154854592e-14 -1.554111322176e-14 ] [ 2.08282960704e-15 1.025393037312e-14 1.217654231808e-14 ] [ 1.506046023552e-14 -1.12152363456e-14 -4.16565921408e-15 ] [ -9.6130597248e-16 8.010883104e-15 3.68500622784e-15 ] [ -1.393893660096e-14 8.8119714144e-15 3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9680601 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.436841622614931e-18 } }