{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.7078481 0.3728003 -11.8494775 ] [ -10.20001 -10.4868044 -0.3268581 ] [ -8.8707339 2.7783133 15.39199 ] [ 6.8174176 -11.5863217 -8.6502765 ] [ 13.3649911 -1.3622699 10.2588168 ] [ 2.2441123 6.3864039 -9.9936853 ] [ 7.3520708 13.8978786 5.1694906 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.71558638848977e-08 5.972919248872262e-10 -1.898495581919563e-08 ] [ -1.634221755392621e-08 -1.680171283658257e-08 -5.236844061391084e-10 ] [ -1.4212482463918e-08 4.451348614517697e-09 2.466068652558739e-08 ] [ 1.092270709295044e-08 -1.856333374880771e-08 -1.385927077175565e-08 ] [ 2.141307627762007e-08 -2.182596984999554e-09 1.643643643403027e-08 ] [ 3.595464261509715e-09 1.023214701956594e-08 -1.601164894329264e-08 ] [ 1.177931595022635e-08 2.226685617163664e-08 8.282436980765364e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 72.517151 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.161852839392233e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.8039601 3.2539953 0.6807691 ] [ 0.5825443 -1.5725842 3.3085258 ] [ 1.3598056 3.0175112 6.3012321 ] [ 5.3727005 -0.5699902 0.6186444 ] [ 6.696933 1.4721656 5.5507847 ] [ 5.0594773 5.8393809 -1.6551149 ] [ 4.9253731 6.3985332 3.8303176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.039601e-11 3.2539953e-10 6.807691e-11 ] [ 5.825443e-11 -1.5725842e-10 3.3085258e-10 ] [ 1.3598056e-10 3.0175112e-10 6.3012321e-10 ] [ 5.3727005e-10 -5.699902e-11 6.186444e-11 ] [ 6.696933e-10 1.4721656e-10 5.5507847e-10 ] [ 5.0594773e-10 5.8393809e-10 -1.6551149e-10 ] [ 4.9253731e-10 6.3985332e-10 3.8303176e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 -0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.846037335159101e-34 } }