{ "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" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8545449 -7.3271199 -17.4305033 ] [ -1.1266565 -0.1524874 -0.0311644 ] [ -14.6451453 -13.4313362 7.0948901 ] [ -9.7998643 7.195687 -4.0424797 ] [ 19.6770985 -12.5650376 8.4937286 ] [ 5.6296106 12.331977 -8.1689098 ] [ 6.1195019 13.948317 14.0844385 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.380014964203873e-09 -1.173934020157843e-08 -2.792674487603725e-08 ] [ -1.805102703972355e-09 -2.443117472465779e-10 -4.993087308125952e-11 ] [ -2.3464109407879e-08 -2.151937284574471e-08 1.136726704536537e-08 ] [ -1.570111346847256e-08 1.152876148199449e-08 -6.476766465398599e-09 ] [ 3.152618718187875e-08 -2.013140948219294e-08 1.360845338634032e-08 ] [ 9.01963048752786e-09 1.975800523764332e-08 -1.3088036298984e-08 ] [ 9.804522875121179e-09 2.234766739690719e-08 2.256575808179542e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 27.024539 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.329808457369781e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.815599 1.7581312 0.9160395 ] [ 1.3913801 3.0872427 5.3115438 ] [ 1.7166819 0.9202734 3.4866208 ] [ 0.8218339 3.7794599 2.9623358 ] [ 4.1098101 1.4945903 3.5809348 ] [ 3.8050224 3.6218428 1.4404007 ] [ 3.5170976 3.7211709 4.4481125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.815599e-10 1.7581312e-10 9.160395e-11 ] [ 1.3913801e-10 3.0872427e-10 5.3115438e-10 ] [ 1.7166819e-10 9.202734000000001e-11 3.4866208e-10 ] [ 8.218339e-11 3.7794599e-10 2.9623358e-10 ] [ 4.1098101e-10 1.4945903e-10 3.5809348e-10 ] [ 3.8050224e-10 3.6218428e-10 1.4404007e-10 ] [ 3.5170976e-10 3.7211709e-10 4.4481125e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.5373582 3.2068128 -2.1987685 ] [ -0.4408611 1.8000045 -0.541563 ] [ 3.0770944 -0.9761481 0.3933474 ] [ 0.430804 0.4550885 1.5925572 ] [ -3.1292313 0.6799377 2.0270687 ] [ -2.8970065 -3.1180242 -1.4207462 ] [ 0.4218423 -2.0476713 0.1481043 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.06529598663517e-09 5.137880495442185e-09 -3.522815485251485e-09 ] [ -7.063373474401708e-10 2.883925127234794e-09 -8.676795772903104e-10 ] [ 4.930048707674603e-09 -1.56396166425834e-09 6.30212008132466e-10 ] [ 6.902240969471232e-10 7.291321550949408e-10 2.551557913126709e-09 ] [ -5.01358122993559e-09 1.089380286540524e-09 3.247722079895449e-09 ] [ -4.641516084605635e-09 -4.995625476328624e-09 -2.276286345730441e-09 ] [ 6.758658707244999e-10 -3.280731083943143e-09 2.372892468999495e-10 ] ] } "relaxed-potential-energy" { "source-value" -16.476905 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.639891197414262e-18 } }