{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.109941 1.98713 2.733868 ] [ 1.585411 0.9055996 0.7031416 ] [ 2.255239 0.4517476 2.903783 ] [ 2.131264 2.335298 0.7662027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109941e-10 1.98713e-10 2.733868e-10 ] [ 1.585411e-10 9.055996e-11 7.031416000000001e-11 ] [ 2.255239e-10 4.517476000000001e-11 2.903783e-10 ] [ 2.131264e-10 2.335298e-10 7.662027e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.3663101 9.9200831 1.9450524 ] [ -17.8194014 -47.7755467 -3.5882083 ] [ 7.2517619 -9.8134655 1.5384454 ] [ 18.9339496 47.6689291 0.1047105 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.34043065550182e-08 1.589372535015828e-08 3.116317507185621e-09 ] [ -2.854982855494689e-08 -7.65448645993158e-08 -5.748943496184861e-09 ] [ 1.161860347151144e-08 -1.572290512266513e-08 2.464861272564783e-09 ] [ 3.033553163845364e-08 7.637404437182264e-08 1.67764716434457e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 5.3005996 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.492496825309746e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.698153 2.076358 2.6032404 ] [ 1.1338984 0.5212515 0.7515873 ] [ 2.6650952 0.6055211 2.6712717 ] [ 2.5847085 2.4766445 1.0808959 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.98153e-11 2.076358e-10 2.6032404e-10 ] [ 1.1338984e-10 5.212515e-11 7.515872999999999e-11 ] [ 2.6650952e-10 6.055211e-11 2.6712717e-10 ] [ 2.5847085e-10 2.4766445e-10 1.0808959e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.6e-06 8e-07 -1.9e-06 ] [ 7.7e-06 5.6e-06 3.4e-06 ] [ -4.3e-06 1.11e-05 -1.23e-05 ] [ -8e-06 -1.75e-05 1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.370012516399999e-15 1.2817413072e-15 -3.0441356046e-15 ] [ 1.23367600818e-14 8.972189150399999e-15 5.4474005556e-15 ] [ -6.8893595262e-15 1.77841606374e-14 -1.97067725982e-14 ] [ -1.2817413072e-14 -2.8038091095e-14 1.73035076472e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.513855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.684505281426407e-18 } }