{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5007148 0.3682109 -1.6374899 ] [ -3.2728114 2.9888275 1.4511757 ] [ -2.0970331 -3.0262364 -0.0254696 ] [ 1.1666058 -1.4456248 -1.4386593 ] [ -1.035562 -0.2614489 0.9159335 ] [ 2.7986046 -1.7701308 2.3422504 ] [ 2.940911 3.1464025 -1.6077409 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.022335462485479e-10 5.899388955037267e-10 -2.62354803457613e-09 ] [ -5.243621909367718e-09 4.788629544104113e-09 2.325039779213075e-09 ] [ -3.359817405863748e-09 -4.848565209093957e-09 -4.080679766112768e-11 ] [ 1.86910853844968e-09 -2.316146257008676e-09 -2.304986295756494e-09 ] [ -1.65915322578889e-09 -4.188873151138771e-10 1.467487239907517e-09 ] [ 4.483858860983336e-09 -2.836062183518001e-09 3.752698830939449e-09 ] [ 4.711858848053549e-09 5.041092525126672e-09 -2.575884882283951e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.497791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.803455165584465e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.983404 2.3269337 1.9296446 ] [ 2.2400277 3.080444 4.2998176 ] [ 2.0449536 0.497321 3.6326182 ] [ 4.399992 0.1484075 2.8688097 ] [ 4.3907253 2.2276249 1.6103152 ] [ 4.1489549 1.3595821 5.0416904 ] [ 4.6469485 3.4184964 3.7134563 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.983404e-10 2.3269337e-10 1.9296446e-10 ] [ 2.2400277e-10 3.080444e-10 4.2998176e-10 ] [ 2.0449536e-10 4.97321e-11 3.6326182e-10 ] [ 4.399992e-10 1.484075e-11 2.8688097e-10 ] [ 4.3907253e-10 2.2276249e-10 1.6103152e-10 ] [ 4.1489549e-10 1.3595821e-10 5.0416904e-10 ] [ 4.6469485e-10 3.4184964e-10 3.7134563e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.3e-05 -2.32e-05 2.74e-05 ] [ -2.48e-05 3.14e-05 1.01e-05 ] [ 9.3e-06 9.9e-06 -2.17e-05 ] [ -1.11e-05 1.82e-05 1.75e-05 ] [ 8.6e-06 -7.9e-06 -1.86e-05 ] [ 7.2e-06 -4.06e-05 -5.5e-06 ] [ -2.2e-06 1.22e-05 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.08282960704e-14 -3.717049760256e-14 4.389963940992e-14 ] [ -3.973398019584e-14 5.030834589312e-14 1.618198387008e-14 ] [ 1.490024257344e-14 1.586154854592e-14 -3.476723267136e-14 ] [ -1.778416049088e-14 2.915961449856e-14 2.8038090864e-14 ] [ 1.377871893888e-14 -1.265719530432e-14 -2.980048514688e-14 ] [ 1.153567166976e-14 -6.504837080448e-14 -8.8119714144e-15 ] [ -3.52478856576e-15 1.954655477376e-14 -1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.651699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148549269679874e-18 } }