{ "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" [ [ 1.999551 1.685791 2.486539 ] [ 2.806467 1.943327 4.558328 ] [ 1.52714 3.922099 3.002179 ] [ 4.336396 2.072479 2.061694 ] [ 5.046676 1.88237 4.081611 ] [ 3.556935 4.352885 1.849563 ] [ 3.300335 4.140991 4.307093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.999551e-10 1.685791e-10 2.486539e-10 ] [ 2.806467e-10 1.943327e-10 4.558328e-10 ] [ 1.52714e-10 3.922099e-10 3.002179e-10 ] [ 4.336396e-10 2.072479e-10 2.061694e-10 ] [ 5.046676e-10 1.88237e-10 4.081611e-10 ] [ 3.556935e-10 4.352885e-10 1.849563e-10 ] [ 3.300335e-10 4.140991e-10 4.307093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9137546 -3.5473043 -2.0216876 ] [ -0.7065509 -1.9866044 4.0177449 ] [ -3.7690625 2.2500866 -1.4065962 ] [ 2.1068267 -1.0624344 -5.1648628 ] [ 2.8077231 -0.954843 1.930281 ] [ 1.5563464 1.2646322 -1.1793239 ] [ 0.9184717 4.0364673 3.8244446 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.668349498868456e-09 -5.683408016323309e-09 -3.239100607281262e-09 ] [ -1.132019333385199e-09 -3.182891124458412e-09 6.437136947118434e-09 ] [ -6.038703819834e-09 3.605036145295361e-09 -2.253615546546122e-09 ] [ 3.375508482817215e-09 -1.702207556813675e-09 -8.275022427799626e-09 ] [ 4.498468308500101e-09 -1.529827131134534e-09 3.092651089774445e-09 ] [ 2.493541815946245e-09 2.02616414475087e-09 -1.889485180930677e-09 ] [ 1.471553884606431e-09 6.4671335386837e-09 6.127435725664808e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.067083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.734448136785313e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0040388 1.7369313 2.7008107 ] [ 3.0402098 1.8467013 4.9341203 ] [ 1.7833332 4.1914226 2.7123973 ] [ 4.23655 1.9696054 1.6834062 ] [ 5.2352529 1.6967374 3.8884642 ] [ 3.8136158 4.3487736 1.3754882 ] [ 2.4604995 4.2097704 5.0523201 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0040388e-10 1.7369313e-10 2.7008107e-10 ] [ 3.0402098e-10 1.8467013e-10 4.9341203e-10 ] [ 1.7833332e-10 4.191422600000001e-10 2.7123973e-10 ] [ 4.23655e-10 1.9696054e-10 1.6834062e-10 ] [ 5.2352529e-10 1.6967374e-10 3.8884642e-10 ] [ 3.8136158e-10 4.3487736e-10 1.3754882e-10 ] [ 2.4604995e-10 4.2097704e-10 5.052320100000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.5e-06 -6.8e-06 4.73e-05 ] [ -3.4e-06 5.39e-05 1e-07 ] [ 2.57e-05 -1.5e-06 8.3e-06 ] [ 2.97e-05 1.3e-06 -7e-06 ] [ -1.4e-05 -1.84e-05 -3.98e-05 ] [ 4.9e-06 8.3e-06 6.6e-06 ] [ -3.43e-05 -3.68e-05 -1.54e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.36185012768e-14 -1.089480102144e-14 7.578295416384e-14 ] [ -5.44740051072e-15 8.635731986112e-14 1.6021766208e-16 ] [ 4.117593915456e-14 -2.4032649312e-15 1.329806595264e-14 ] [ 4.758464563776e-14 2.08282960704e-15 -1.12152363456e-14 ] [ -2.24304726912e-14 -2.948004982272e-14 -6.376662950784e-14 ] [ 7.850665441919999e-15 1.329806595264e-14 1.057436569728e-14 ] [ -5.495465809344e-14 -5.896009964544001e-14 -2.467351996032e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.146068 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.387973577144701e-18 } }