{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8203983 0.2840639 -0.280662 ] [ 0.6027676 0.1796061 -2.3608652 ] [ -2.6127482 -1.0165878 1.7089408 ] [ 1.7952215 1.6525986 0.0194644 ] [ -0.9205705 -2.7057711 -3.6640287 ] [ -0.7904064 0.2530176 -0.6451122 ] [ 1.1053377 1.3530727 5.2222628 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.314422986833322e-09 4.551205431429125e-10 -4.49670098451708e-10 ] [ 9.657401644522582e-10 2.877606967438673e-10 -3.782523059463736e-09 ] [ -4.186084116565558e-09 -1.628753219569465e-09 2.738025018649267e-09 ] [ 2.876261940154431e-09 2.647754862301112e-09 3.11854068748296e-11 ] [ -1.474916545049697e-09 -4.335123233372478e-09 -5.870421169445395e-09 ] [ -1.266370665444057e-09 4.053788867107584e-10 -1.033583693148335e-09 ] [ 1.770946235619302e-09 2.167861464043291e-09 8.366987434767414e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.380647 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.10512197752022e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2474006 1.9476414 3.6254269 ] [ 2.0091569 3.690601 0.82189 ] [ 1.0878537 3.9337371 3.0050302 ] [ 3.0401324 5.1609809 3.6021071 ] [ 3.5587752 2.0542502 1.6265757 ] [ 4.1447117 4.4294072 1.6093313 ] [ 4.3208124 3.1410792 3.6816007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2474006e-10 1.9476414e-10 3.6254269e-10 ] [ 2.0091569e-10 3.690601e-10 8.218900000000001e-11 ] [ 1.0878537e-10 3.9337371e-10 3.0050302e-10 ] [ 3.0401324e-10 5.160980900000001e-10 3.6021071e-10 ] [ 3.5587752e-10 2.0542502e-10 1.6265757e-10 ] [ 4.144711700000001e-10 4.4294072e-10 1.6093313e-10 ] [ 4.320812400000001e-10 3.1410792e-10 3.681600700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.21e-05 2.78e-05 -4.5e-06 ] [ 2.02e-05 9.7e-06 3.13e-05 ] [ 2.34e-05 -9.7e-06 -2.5e-06 ] [ -2.17e-05 -1.47e-05 -1.8e-06 ] [ -1.16e-05 -1.92e-05 -3.4e-06 ] [ 1.1e-06 -4e-06 4.4e-06 ] [ -2.35e-05 1.01e-05 -2.36e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.93863372714e-14 4.454051042519999e-14 -7.209794853e-15 ] [ 3.236396800679999e-14 1.55411133498e-14 5.014812864419999e-14 ] [ 3.749093323559999e-14 -1.55411133498e-14 -4.005441585e-15 ] [ -3.476723295779999e-14 -2.35519965198e-14 -2.8839179412e-15 ] [ -1.85852489544e-14 -3.076179137279999e-14 -5.4474005556e-15 ] [ 1.7623942974e-15 -6.408706535999999e-15 7.0495771896e-15 ] [ -3.765115089899999e-14 1.61819840034e-14 -3.78113685624e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.541441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.451319343288959e-18 } }