{ "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" [ [ -0.147926 -1.598277 1.181859 ] [ 6.6796025 1.2359366 -2.9504233 ] [ 1.626883 3.1196044 -0.3794204 ] [ 1.2774791 3.2189402 4.1254718 ] [ -4.0267649 7.3858595 -4.094573 ] [ -5.1656332 -8.2764462 3.3606842 ] [ -0.2436405 -5.0856177 -1.2435984 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.370035788084608e-10 -2.560722042962362e-09 1.893546858882067e-09 ] [ 1.070190296173723e-08 1.980188725311041e-09 -4.727099232723585e-09 ] [ 2.606553907376967e-09 4.998157235824812e-09 -6.078984943345842e-10 ] [ 2.046747147580625e-09 5.157310732193276e-09 6.609734467729693e-09 ] [ -6.45158858023805e-09 1.183345141541358e-08 -6.560229132758917e-09 ] [ -8.27625674466829e-09 -1.3260328604949e-08 5.384409655131952e-09 ] [ -3.903551129800224e-10 -8.148057781266668e-09 -1.992464282144287e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -39.515951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.331153284087838e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6556619 2.5855665 2.0631425 ] [ 2.0951044 2.6130466 4.1965272 ] [ 2.1933535 4.5018618 3.0532954 ] [ 4.7376557 2.1236299 1.4788711 ] [ 4.1728007 2.1514142 3.61654 ] [ 4.2712407 4.0438947 2.4710896 ] [ 3.7075522 4.0685504 4.6036822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6556619e-10 2.5855665e-10 2.0631425e-10 ] [ 2.0951044e-10 2.6130466e-10 4.196527200000001e-10 ] [ 2.1933535e-10 4.501861800000001e-10 3.0532954e-10 ] [ 4.7376557e-10 2.1236299e-10 1.4788711e-10 ] [ 4.1728007e-10 2.1514142e-10 3.61654e-10 ] [ 4.2712407e-10 4.0438947e-10 2.4710896e-10 ] [ 3.7075522e-10 4.068550400000001e-10 4.6036822e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.55e-05 4.23e-05 1.65e-05 ] [ -2.14e-05 -2e-06 3.24e-05 ] [ 1e-05 -5.95e-05 -3.55e-05 ] [ 8.7e-06 -9.4e-06 2.8e-05 ] [ -4.6e-06 -6.42e-05 2.5e-05 ] [ 5.82e-05 0.0001236 -0.0001558 ] [ -1.54e-05 -3.1e-05 8.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.68772700384e-14 6.777207105984e-14 2.64359142432e-14 ] [ -3.428657968511999e-14 -3.2043532416e-15 5.191052251392001e-14 ] [ 1.6021766208e-14 -9.532950893760001e-14 -5.68772700384e-14 ] [ 1.393893660096e-14 -1.506046023552e-14 4.48609453824e-14 ] [ -7.370012455680001e-15 -1.0285973905536e-13 4.005441552e-14 ] [ 9.324667933055999e-14 1.9802903033088e-13 -2.4961911752064e-13 ] [ -2.467351996032e-14 -4.96674752448e-14 1.4323458989952e-13 ] ] } "relaxed-potential-energy" { "source-value" -50.517683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.093825063958561e-18 } }