{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.344878 2.219137 2.797465 ] [ 2.001288 4.461966 3.139291 ] [ 3.23388 2.535754 1.187329 ] [ 4.3257 4.424828 2.075195 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.344878e-10 2.219137e-10 2.797465e-10 ] [ 2.001288e-10 4.461966000000001e-10 3.139291e-10 ] [ 3.23388e-10 2.535754e-10 1.187329e-10 ] [ 4.3257e-10 4.424828e-10 2.075195e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2133124 0.8061735 -0.9614789 ] [ 1.0649119 -0.0763413 -0.1162969 ] [ -0.453885 -0.4088491 0.6629506 ] [ -1.8243393 -0.3209831 0.4148252 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.943940777022462e-09 1.291632344649999e-09 -1.540459027664022e-09 ] [ 1.706176963448544e-09 -1.223122470691842e-10 -1.863281757866346e-10 ] [ -7.272039415230899e-10 -6.550484748519294e-10 1.06216396081628e-09 ] [ -2.922913798947916e-09 -5.142716227288854e-10 6.646232426343768e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.016158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.604765431005217e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.441266 2.4131584 2.5859438 ] [ 2.1270688 4.4779944 3.3286041 ] [ 3.3258018 2.3428498 1.2710352 ] [ 4.0116093 4.4076824 2.0136969 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.441266e-10 2.4131584e-10 2.5859438e-10 ] [ 2.1270688e-10 4.4779944e-10 3.3286041e-10 ] [ 3.3258018e-10 2.3428498e-10 1.2710352e-10 ] [ 4.0116093e-10 4.4076824e-10 2.0136969e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.5e-06 1.64e-05 1.35e-05 ] [ 8.5e-06 -1.75e-05 -1.36e-05 ] [ 1.5e-05 3.6e-06 -5.6e-06 ] [ -1.41e-05 -2.5e-06 5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.5220678023e-14 2.62756967976e-14 2.162938455899999e-14 ] [ 1.3618501389e-14 -2.8038091095e-14 -2.17896022224e-14 ] [ 2.403264951e-14 5.767835882399999e-15 -8.972189150399999e-15 ] [ -2.25906905394e-14 -4.005441585e-15 9.1324068138e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.595935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.697655947238279e-18 } }