{ "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" [ [ 0.1779892 2.357943 0.2667025 ] [ 0.683577 1.802827 2.30843 ] [ 1.994264 0.9284256 0.4445094 ] [ 2.959137 1.015728 2.327469 ] [ 2.670153 2.85418 1.122954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.779892e-11 2.357943e-10 2.667025e-11 ] [ 6.83577e-11 1.802827e-10 2.30843e-10 ] [ 1.994264e-10 9.284256e-11 4.445094e-11 ] [ 2.959137e-10 1.015728e-10 2.327469e-10 ] [ 2.670153e-10 2.85418e-10 1.122954e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2429816 2.7128569 -10.793509 ] [ -16.0722341 -2.8231063 28.9925992 ] [ -6.5613501 -23.3232963 -37.2263437 ] [ 11.0173161 -11.1685517 27.1218469 ] [ 15.8592497 34.6020974 -8.0945935 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.798005978011934e-09 4.346475936565674e-09 -1.72931079186687e-08 ] [ -2.575055793119802e-08 -4.523114949158194e-09 4.645126499716709e-08 ] [ -1.051244181771356e-08 -3.736804035971865e-08 -5.96431780453931e-08 ] [ 1.7651686424812e-08 -1.789399256936097e-08 4.345398937410534e-08 ] [ 2.540931930211151e-08 5.543867194167214e-08 -1.296896856742828e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.50235496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.048613788860046e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.1687868 2.1740287 0.2543057 ] [ 0.6539684 2.1950734 2.8145418 ] [ 2.2900839 0.7116093 -0.1356755 ] [ 2.7752616 0.7326483 2.4245614 ] [ 2.5970195 3.1457438 1.1123314 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.687868e-11 2.1740287e-10 2.543057e-11 ] [ 6.539684e-11 2.1950734e-10 2.814541800000001e-10 ] [ 2.2900839e-10 7.116093e-11 -1.356755e-11 ] [ 2.7752616e-10 7.326483000000001e-11 2.4245614e-10 ] [ 2.5970195e-10 3.1457438e-10 1.1123314e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 3.2e-06 -5.2e-06 ] [ 1e-06 1.4e-06 5e-06 ] [ -6e-07 3e-07 -6.6e-06 ] [ 3.9e-06 7e-07 6.7e-06 ] [ -5.9e-06 -5.6e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.5634826144e-15 5.1269652288e-15 -8.331318496799998e-15 ] [ 1.602176634e-15 2.2430472876e-15 8.010883169999999e-15 ] [ -9.613059803999998e-16 4.806529901999999e-16 -1.05743657844e-14 ] [ 6.248488872599999e-15 1.1215236438e-15 1.07345834478e-14 ] [ -9.452842140600001e-15 -8.972189150399999e-15 1.602176634e-16 ] ] } "relaxed-potential-energy" { "source-value" -15.98496 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.561072940742464e-18 } }