{ "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" [ [ 2.007741 0.810981 1.851579 ] [ 2.28758 2.972606 1.775704 ] [ 2.775609 2.277586 3.884458 ] [ 3.461309 1.568578 0.4572952 ] [ 4.556331 2.173826 2.191246 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.007741e-10 8.10981e-11 1.851579e-10 ] [ 2.28758e-10 2.972606e-10 1.775704e-10 ] [ 2.775609000000001e-10 2.277586e-10 3.884458e-10 ] [ 3.461309e-10 1.568578e-10 4.572952e-11 ] [ 4.556331e-10 2.173826e-10 2.191246e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.4588975 -3.8949281 3.9472115 ] [ -2.8274507 6.7134064 -0.6533646 ] [ 0.5794286 -1.7109175 0.4998181 ] [ 2.0716818 -1.9694851 -8.0971625 ] [ 2.6352378 0.8619243 4.3034975 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.939588119901015e-09 -6.240362792930015e-09 6.324130034756091e-09 ] [ -4.530075445326943e-09 1.075606286862606e-08 -1.046805495602756e-09 ] [ 9.283469639913323e-10 -2.741192041201695e-09 8.007968810702754e-10 ] [ 3.319200173043061e-09 -3.155463008231153e-09 -1.297308455920102e-08 ] [ 4.222116428193565e-09 1.380954973736806e-09 6.894963138977414e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.61112004636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.700088859886117e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1884875 0.8385104 2.0540067 ] [ 2.3242097 3.196458 1.686343 ] [ 2.7503251 2.1078607 3.8105811 ] [ 3.4456095 1.5253158 0.3341375 ] [ 4.3799382 2.1354321 2.2752139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1884875e-10 8.385104e-11 2.0540067e-10 ] [ 2.3242097e-10 3.196458e-10 1.686343e-10 ] [ 2.7503251e-10 2.1078607e-10 3.8105811e-10 ] [ 3.4456095e-10 1.5253158e-10 3.341375e-11 ] [ 4.3799382e-10 2.1354321e-10 2.2752139e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.2392704 -0.3607634 0.0230304 ] [ -0.1577725 0.2613548 -0.073391 ] [ -0.0533549 0.0636431 0.1392384 ] [ 0.0127433 0.0139103 -0.177329 ] [ 0.4376546 0.0218553 0.0884512 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.833534440878336e-10 -5.780066898823956e-10 3.68987687516736e-11 ] [ -2.52779412987765e-10 4.187365537437432e-10 -1.17585345345894e-10 ] [ -8.548397408940658e-11 1.019674877353254e-10 2.230845110355456e-10 ] [ 2.04170175000522e-11 2.22867576319302e-11 -2.84112380330586e-10 ] [ 7.011999738826163e-10 3.50160509890602e-11 1.417144458892608e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.88347004636885 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.064159467313106e-18 } }