{ "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" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1795986 0.1700788 -0.1689355 ] [ -0.3610767 1.1928687 0.1449864 ] [ 1.0525639 -1.6409423 3.047321 ] [ 1.1637281 0.3464622 -2.3218901 ] [ -0.6756167 -0.0684674 -0.7014818 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.889925298848411e-09 2.724962770537191e-10 -2.706645085231584e-10 ] [ -5.785086470556153e-10 1.911186342824089e-09 2.322938204139571e-10 ] [ 1.686393272478069e-09 -2.62907938914178e-09 4.882346462272877e-09 ] [ 1.864497954788004e-09 5.550936368309337e-10 -3.720078034286974e-09 ] [ -1.082457281362047e-09 -1.096968675669619e-10 -1.123897739876701e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.397124 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.466891210035858e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.44708 2.6940286 3.1311285 ] [ 2.6609222 4.6731141 1.5203445 ] [ 4.386636 2.783314 1.4325304 ] [ 4.7922701 1.9212402 3.8093802 ] [ 4.3460747 4.4141981 3.4309374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.44708e-10 2.6940286e-10 3.1311285e-10 ] [ 2.6609222e-10 4.673114100000001e-10 1.5203445e-10 ] [ 4.386636e-10 2.783314e-10 1.4325304e-10 ] [ 4.7922701e-10 1.9212402e-10 3.8093802e-10 ] [ 4.3460747e-10 4.4141981e-10 3.4309374e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.16e-05 -1.26e-05 -2.73e-05 ] [ 1.66e-05 -1.52e-05 1.2e-06 ] [ -5.12e-05 1.9e-05 2.51e-05 ] [ -1.66e-05 1.6e-05 2.2e-06 ] [ 9.6e-06 -7.2e-06 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.665054742528e-14 -2.018742542208e-14 -4.373942174784e-14 ] [ 2.659613190528e-14 -2.435308463616e-14 1.92261194496e-15 ] [ -8.203144298496001e-14 3.04413557952e-14 4.021463318208e-14 ] [ -2.659613190528e-14 2.56348259328e-14 3.52478856576e-15 ] [ 1.538089555968e-14 -1.153567166976e-14 -1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.118168 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.58241519397267e-18 } }