{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0259569 0.2123667 -1.4304097 ] [ 0.2025368 -0.080601 1.6181708 ] [ -0.9193919 0.1140548 -0.9723771 ] [ -0.2196124 0.2993682 -0.3064201 ] [ 0.2704406 -0.0067429 -0.2642905 ] [ 0.034405 0.3283533 0.8112206 ] [ 0.605665 -0.8667992 0.544106 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.158753867107459e-11 3.402489645796877e-10 -2.29176899838695e-09 ] [ 3.244997284851311e-10 -1.29137038877034e-10 2.592595445581087e-09 ] [ -1.473028219668864e-09 1.827359355555432e-10 -1.557919869056681e-09 ] [ -3.518578558166615e-10 4.796407350026387e-10 -4.909391244079433e-10 ] [ 4.332936102049403e-10 -1.08033168253986e-11 -4.234400636881769e-10 ] [ 5.512288709276999e-11 5.260799849567922e-10 1.29971869033946e-09 ] [ 9.703823110316099e-10 -1.388765424609892e-09 8.717539196192039e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.497501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.284061715759163e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5975624 1.6208238 1.7181777 ] [ 1.8812577 2.0272986 4.0498673 ] [ 2.5002759 3.735483 2.3473191 ] [ 3.7675755 0.6998576 1.5831212 ] [ 4.727594 2.7901901 2.2087247 ] [ 4.108568 1.0819955 3.9112517 ] [ 3.8032514 3.4101677 4.3154103 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5975624e-10 1.6208238e-10 1.7181777e-10 ] [ 1.8812577e-10 2.0272986e-10 4.0498673e-10 ] [ 2.5002759e-10 3.735483e-10 2.3473191e-10 ] [ 3.7675755e-10 6.998576e-11 1.5831212e-10 ] [ 4.727594e-10 2.7901901e-10 2.2087247e-10 ] [ 4.108568e-10 1.0819955e-10 3.9112517e-10 ] [ 3.8032514e-10 3.4101677e-10 4.3154103e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-05 -4.2e-06 -4.68e-05 ] [ -1.26e-05 1.05e-05 3.5e-06 ] [ 2.46e-05 -2.95e-05 6.79e-05 ] [ 3.9e-06 -2.62e-05 -1.01e-05 ] [ -6.2e-06 -1.58e-05 -3.4e-06 ] [ 9.3e-06 5.67e-05 -7.6e-06 ] [ 0.0 8.5e-06 -3.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.0441356046e-14 -6.729141862799999e-15 -7.498186647119999e-14 ] [ -2.01874255884e-14 1.6822854657e-14 5.607618218999999e-15 ] [ 3.94135451964e-14 -4.726421070299999e-14 1.087877934486e-13 ] [ 6.248488872599999e-15 -4.197702781079999e-14 -1.61819840034e-14 ] [ -9.9334951308e-15 -2.53143908172e-14 -5.4474005556e-15 ] [ 1.49002426962e-14 9.08434151478e-14 -1.21765424184e-14 ] [ 0.0 1.3618501389e-14 -5.607618218999999e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864829040116e-18 } }