{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.36533 -11.7793922 -19.194355 ] [ -6.3504902 -2.4901676 6.0748652 ] [ -13.4582748 20.0788219 28.5738439 ] [ 20.4582392 -24.973977 8.0839345 ] [ 12.7158558 19.1647148 -23.5382886 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.141361925527686e-08 -1.887266679007388e-08 -3.075274683233558e-08 ] [ -1.017460692905952e-08 -3.989688310593646e-09 9.733006997951516e-09 ] [ -2.15625332408618e-08 3.216981902138703e-08 4.57803446629687e-08 ] [ 3.27777125489741e-08 -4.001272207779693e-08 1.295189085997854e-08 ] [ 2.037304687622408e-08 3.070525799685974e-08 -3.771249568856316e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.472826400765051 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.517714099220278e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8217801 0.7783134 0.6625578 ] [ 0.1666522 0.8532645 2.92242 ] [ 1.3969195 2.8391337 3.2132009 ] [ 2.464163 0.9075068 2.3605215 ] [ 2.0520746 2.7641717 0.9533413 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.217801000000001e-11 7.783134e-11 6.625578e-11 ] [ 1.666522e-11 8.532645e-11 2.92242e-10 ] [ 1.3969195e-10 2.8391337e-10 3.2132009e-10 ] [ 2.464163e-10 9.075068e-11 2.3605215e-10 ] [ 2.0520746e-10 2.7641717e-10 9.533413e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.22e-05 2.4e-05 -1.66e-05 ] [ 3.62e-05 2.08e-05 -1.92e-05 ] [ 4.4e-05 -4.95e-05 -5.81e-05 ] [ -3.39e-05 2.21e-05 6.03e-05 ] [ -5.85e-05 -1.74e-05 3.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.954655477376e-14 3.84522388992e-14 -2.659613190528e-14 ] [ 5.799879367296e-14 3.332527371264e-14 -3.076179111936e-14 ] [ 7.04957713152e-14 -7.930774272959999e-14 -9.308646166848001e-14 ] [ -5.431378744512e-14 3.540810331968e-14 9.661125023424001e-14 ] [ -9.37273323168e-14 -2.787787320192e-14 5.383313445888e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.34072039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.55677736188388e-19 } }