{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.689863 2.613928 1.941703 ] [ 2.080356 5.103994 1.950756 ] [ 1.651882 3.89841 3.770183 ] [ 3.604737 2.326315 3.946353 ] [ 4.359532 3.977463 2.369793 ] [ 3.455978 5.487629 3.928773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.689863e-10 2.613928e-10 1.941703e-10 ] [ 2.080356e-10 5.103994e-10 1.950756e-10 ] [ 1.651882e-10 3.89841e-10 3.770183e-10 ] [ 3.604737e-10 2.326315e-10 3.946353e-10 ] [ 4.359532e-10 3.977463000000001e-10 2.369793e-10 ] [ 3.455978e-10 5.487629000000001e-10 3.928773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8403772 -8.2898327 -8.8418963 ] [ -5.3171731 7.0705895 -7.6447992 ] [ -12.1226696 -1.1294408 9.6432403 ] [ 2.9146731 -6.3041824 7.0316221 ] [ 15.1972272 2.7144712 -4.9900628 ] [ 3.1683196 5.9383952 4.8018958 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.152962564893366e-09 -1.328177614228334e-08 -1.416627953539802e-08 ] [ -8.51905042956666e-09 1.132833319217396e-08 -1.224831854895054e-08 ] [ -1.942265781480289e-08 -1.809563644337649e-09 1.545017415741638e-08 ] [ 4.66982109809466e-09 -1.010041365453883e-08 1.12659005349206e-08 ] [ 2.434864212082585e-08 4.349062294474921e-09 -7.994961954483786e-09 ] [ 5.076207590342408e-09 9.514357954510941e-09 7.693485186277713e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5022182 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.815525362580258e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.9576107 2.9189478 1.3341337 ] [ 1.5593257 4.7500487 2.0005417 ] [ 1.7773425 4.0129915 4.4830597 ] [ 3.1756465 2.1819047 3.8166518 ] [ 4.8853586 3.8563792 2.8033747 ] [ 3.4870641 5.6874671 3.4697994 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9576107e-10 2.9189478e-10 1.3341337e-10 ] [ 1.5593257e-10 4.7500487e-10 2.0005417e-10 ] [ 1.7773425e-10 4.0129915e-10 4.4830597e-10 ] [ 3.1756465e-10 2.1819047e-10 3.8166518e-10 ] [ 4.8853586e-10 3.8563792e-10 2.8033747e-10 ] [ 3.4870641e-10 5.687467100000001e-10 3.4697994e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.1e-06 1.09e-05 -1.3e-05 ] [ -1.12e-05 -1.7e-05 -6.9e-06 ] [ 9.6e-06 1.5e-06 6.9e-06 ] [ -7.1e-06 2.31e-05 -2.2e-06 ] [ 8e-06 3.1e-06 1.6e-05 ] [ 6.9e-06 -2.16e-05 -9e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.77327738688e-15 1.746372516672e-14 -2.08282960704e-14 ] [ -1.794437815296e-14 -2.72370025536e-14 -1.105501868352e-14 ] [ 1.538089555968e-14 2.4032649312e-15 1.105501868352e-14 ] [ -1.137545400768e-14 3.701027994048e-14 -3.52478856576e-15 ] [ 1.28174129664e-14 4.96674752448e-15 2.56348259328e-14 ] [ 1.105501868352e-14 -3.460701500928e-14 -1.44195895872e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.187542 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.273094809901807e-18 } }