{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1872059 -3.7636018 -2.2035448 ] [ -4.1679479 -5.8132099 -0.3359885 ] [ -6.5082411 4.8358588 7.4565156 ] [ -1.0881726 2.9936687 0.2101868 ] [ 1.1852668 -0.5464847 -5.2945291 ] [ 8.074923 -3.0054107 4.0593544 ] [ 2.3169659 5.2991796 -3.8919944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.999369162558228e-10 -6.029954813960798e-09 -3.530467961445412e-09 ] [ -6.677788682092455e-09 -9.313788993583107e-09 -5.383129195576608e-10 ] [ -1.042735173294968e-08 7.747899910849943e-09 1.194665496695049e-08 ] [ -1.74344469911515e-09 4.79638600156073e-09 3.367563769607655e-10 ] [ 1.89900675637043e-09 -8.755650099649018e-10 -8.482770742165266e-09 ] [ 1.29374528453602e-08 -4.815198759442163e-09 6.503802715221612e-09 ] [ 3.712188596170831e-09 8.490221664540297e-09 -6.235662435964524e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.865262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.061242199686665e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4471017 1.2373789 1.9892607 ] [ 2.4717177 0.1961801 4.0753916 ] [ 2.3886401 2.6132754 4.9556557 ] [ 1.5587428 3.5889593 2.7486332 ] [ 3.9892158 1.2693351 2.2089756 ] [ 4.734992 1.5086019 4.6949726 ] [ 4.0640748 3.6422281 3.2029025 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4471017e-10 1.2373789e-10 1.9892607e-10 ] [ 2.4717177e-10 1.961801e-11 4.0753916e-10 ] [ 2.3886401e-10 2.6132754e-10 4.955655700000001e-10 ] [ 1.5587428e-10 3.5889593e-10 2.7486332e-10 ] [ 3.9892158e-10 1.2693351e-10 2.2089756e-10 ] [ 4.734992e-10 1.5086019e-10 4.6949726e-10 ] [ 4.0640748e-10 3.6422281e-10 3.2029025e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.1e-06 8e-06 2.2e-06 ] [ -2.5e-06 -5.6e-06 -3e-07 ] [ 1.06e-05 -5.8e-06 -4.9e-06 ] [ 1.37e-05 -6.7e-06 -2.4e-06 ] [ -1.4e-05 1.2e-06 -4.8e-06 ] [ -2.2e-06 1.21e-05 8e-06 ] [ -1.07e-05 -3.2e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.17110076608e-15 1.28174129664e-14 3.52478856576e-15 ] [ -4.005441552e-15 -8.972189076479999e-15 -4.8065298624e-16 ] [ 1.698307218048e-14 -9.292624400640001e-15 -7.850665441919999e-15 ] [ 2.194981970496e-14 -1.073458335936e-14 -3.84522388992e-15 ] [ -2.24304726912e-14 1.92261194496e-15 -7.69044777984e-15 ] [ -3.52478856576e-15 1.938633711168e-14 1.28174129664e-14 ] [ -1.714328984256e-14 -5.126965186560001e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.272513 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767361651106407e-18 } }