{ "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" [ [ 2.743053 2.538085 1.844122 ] [ 1.813323 2.641816 4.57084 ] [ 2.418782 4.209438 3.124504 ] [ 4.81693 2.098767 1.448798 ] [ 3.906107 2.029734 3.728536 ] [ 4.411251 4.516232 1.926861 ] [ 3.723923 4.053892 4.839487 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743053e-10 2.538085e-10 1.844122e-10 ] [ 1.813323e-10 2.641816e-10 4.57084e-10 ] [ 2.418782e-10 4.209438e-10 3.124504e-10 ] [ 4.81693e-10 2.098767e-10 1.448798e-10 ] [ 3.906107e-10 2.029734e-10 3.728536e-10 ] [ 4.411251e-10 4.516232e-10 1.926861e-10 ] [ 3.723923e-10 4.053892e-10 4.839487000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6159052 -1.8017899 -2.8132326 ] [ -1.7289999 -1.5028758 1.442377 ] [ -2.5057641 4.7792334 -1.3712091 ] [ 2.1386768 0.186942 -0.2521854 ] [ 2.0222658 -2.4879441 0.9777877 ] [ 0.5315845 -0.2390068 -0.2107245 ] [ 2.158142 1.0654412 2.227187 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.191142153669148e-09 -2.88678565337357e-09 -4.507295500592399e-09 ] [ -2.770163217145538e-09 -2.407872470726097e-09 2.310942707779642e-09 ] [ -4.014676658259953e-09 7.657176018826495e-09 -2.196919162248209e-09 ] [ 3.426537968407358e-09 2.995141018455936e-10 -4.040455519870963e-10 ] [ 3.240026985803408e-09 -3.986125870877297e-09 1.566588593045804e-09 ] [ 8.516922578796576e-10 -3.829311071722214e-10 -3.376178673297696e-10 ] [ 3.457724656766553e-09 1.707024981477097e-09 3.568346941549689e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -22.211209 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.558627977950255e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1539889 2.4377016 1.7536811 ] [ 2.080066 2.4661447 4.1493901 ] [ 2.2349168 4.5639263 2.8574513 ] [ 4.5034147 2.2582318 1.7439701 ] [ 4.3709124 1.7684181 4.0449755 ] [ 4.5752609 4.5367633 2.3399942 ] [ 3.9148093 4.0567781 4.5936858 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1539889e-10 2.4377016e-10 1.7536811e-10 ] [ 2.080066e-10 2.4661447e-10 4.1493901e-10 ] [ 2.2349168e-10 4.5639263e-10 2.8574513e-10 ] [ 4.503414700000001e-10 2.2582318e-10 1.7439701e-10 ] [ 4.3709124e-10 1.7684181e-10 4.0449755e-10 ] [ 4.5752609e-10 4.5367633e-10 2.3399942e-10 ] [ 3.9148093e-10 4.0567781e-10 4.5936858e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.7e-06 -2.42e-05 -9.4e-06 ] [ 8e-07 -8.7e-06 2.29e-05 ] [ 1.5e-06 1.92e-05 -1.34e-05 ] [ -9.7e-06 2.32e-05 8.4e-06 ] [ -1.6e-05 7.6e-06 -5.2e-06 ] [ 6.6e-06 1e-06 -4.2e-06 ] [ 9.1e-06 -1.81e-05 9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.233675998016e-14 -3.877267422336e-14 -1.506046023552e-14 ] [ 1.28174129664e-15 -1.393893660096e-14 3.668984461632e-14 ] [ 2.4032649312e-15 3.076179111936e-14 -2.146916671872e-14 ] [ -1.554111322176e-14 3.717049760256e-14 1.345828361472e-14 ] [ -2.56348259328e-14 1.217654231808e-14 -8.33131842816e-15 ] [ 1.057436569728e-14 1.6021766208e-15 -6.72914180736e-15 ] [ 1.457980724928e-14 -2.899939683648e-14 1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }