{ "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" [ [ 0.0647644 0.143829 0.6473224 ] [ 1.313892 1.683397 0.0769283 ] [ 0.1194939 2.399252 1.546304 ] [ 2.728192 0.2406182 0.1106797 ] [ 2.458193 2.956348 2.547264 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.47644e-12 1.43829e-11 6.473223999999999e-11 ] [ 1.313892e-10 1.683397e-10 7.69283e-12 ] [ 1.194939e-11 2.399252e-10 1.546304e-10 ] [ 2.728192e-10 2.406182e-11 1.106797e-11 ] [ 2.458193e-10 2.956348e-10 2.547264000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6894595 -4.6058772 1.5349353 ] [ 3.1949811 7.0370817 -8.2304304 ] [ -2.4469855 2.9339878 6.554405 ] [ 3.7257113 -5.0640987 0.6404262 ] [ -1.7842474 -0.3010936 -0.499336 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.308989168989323e-09 -7.379428828913344e-09 2.45923747236178e-09 ] [ 5.118924064491617e-09 1.1274647871289e-08 -1.318660327464327e-08 ] [ -3.920502991836806e-09 4.700766697601065e-09 1.050131454077277e-08 ] [ 5.969247589889763e-09 -8.113580609409774e-09 1.026075893441411e-09 ] [ -2.858679493555251e-09 -4.824051305669424e-10 -8.000244717150239e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.9517928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.434235325656943e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.528254 0.176043 1.0775149 ] [ 1.3793821 1.8797164 -0.5032714 ] [ 0.3664044 2.5063518 1.564256 ] [ 2.4365465 -0.2230064 -0.2626729 ] [ 1.9739483 3.0843394 3.0526717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.28254e-11 1.76043e-11 1.0775149e-10 ] [ 1.3793821e-10 1.8797164e-10 -5.032714000000001e-11 ] [ 3.664044e-11 2.5063518e-10 1.564256e-10 ] [ 2.4365465e-10 -2.230064e-11 -2.626729e-11 ] [ 1.9739483e-10 3.0843394e-10 3.0526717e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.7e-06 -1.95e-05 2.23e-05 ] [ -6.6e-06 1.47e-05 5.6e-06 ] [ -5e-06 3.55e-05 -1.01e-05 ] [ 1.7e-05 -6.3e-06 -6e-06 ] [ -3.7e-06 -2.45e-05 -1.18e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.7237002778e-15 -3.1242444363e-14 3.572853893819999e-14 ] [ -1.05743657844e-14 2.35519965198e-14 8.972189150399999e-15 ] [ -8.010883169999999e-15 5.6877270507e-14 -1.61819840034e-14 ] [ 2.723700277799999e-14 -1.00937127942e-14 -9.613059803999999e-15 ] [ -5.9280535458e-15 -3.925332753299999e-14 -1.89056842812e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.225848 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.119014463043563e-18 } }