{ "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" [ [ 2.649462 0.9916265 2.612716 ] [ 1.648491 2.667782 3.780456 ] [ 2.525478 3.798893 2.25676 ] [ 4.349928 2.588165 2.084291 ] [ 3.878534 1.770814 4.034173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.649462e-10 9.916265e-11 2.612716e-10 ] [ 1.648491e-10 2.667782e-10 3.780456e-10 ] [ 2.525478e-10 3.798893e-10 2.25676e-10 ] [ 4.349928e-10 2.588165e-10 2.084291e-10 ] [ 3.878534e-10 1.770814e-10 4.034173e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.9802612 -16.543977 -10.1204977 ] [ -10.0548069 -1.5224069 7.9237375 ] [ -0.3409255 11.8534665 -7.8285127 ] [ 10.7920059 4.9077204 -7.1590181 ] [ 13.5839877 1.3051971 17.1842911 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.239884764731735e-08 -2.650637316445292e-08 -1.621482480580017e-08 ] [ -1.610957654183853e-08 -2.439164742524604e-09 1.269522697185624e-08 ] [ -5.462228655345503e-10 1.8991346901736e-08 -1.254266002357588e-08 ] [ 1.729069954451566e-08 7.863034886303224e-09 -1.147001142770404e-08 ] [ 2.176394751017477e-08 2.09115627915596e-09 2.753226944544152e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.0141189 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.226974213091414e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2356298 0.2567681 2.6041412 ] [ 1.9912919 2.2699497 3.6646779 ] [ 2.4789529 3.8742493 1.8332805 ] [ 4.9799537 3.5370618 2.3905389 ] [ 4.3660647 1.8792517 4.2757575 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2356298e-10 2.567681e-11 2.6041412e-10 ] [ 1.9912919e-10 2.2699497e-10 3.6646779e-10 ] [ 2.4789529e-10 3.8742493e-10 1.8332805e-10 ] [ 4.979953700000001e-10 3.5370618e-10 2.3905389e-10 ] [ 4.3660647e-10 1.8792517e-10 4.2757575e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.06e-05 1.3e-05 1.89e-05 ] [ -1.05e-05 -1.12e-05 -2.48e-05 ] [ -4.2e-06 1.31e-05 -4.6e-06 ] [ -7.2e-06 -4.4e-06 6.6e-06 ] [ 1.12e-05 -1.05e-05 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.698307218048e-14 2.08282960704e-14 3.028113813312e-14 ] [ -1.68228545184e-14 -1.794437815296e-14 -3.973398019584e-14 ] [ -6.72914180736e-15 2.098851373248e-14 -7.370012455680001e-15 ] [ -1.153567166976e-14 -7.04957713152e-15 1.057436569728e-14 ] [ 1.794437815296e-14 -1.68228545184e-14 6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }