{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.11534 0 0 ] "si-unit" "m" "si-value" [ 5.11534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.215947 5.44617 0 ] "si-unit" "m" "si-value" [ -2.15947e-11 5.446170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.311017 -0.240161 5.43903 ] "si-unit" "m" "si-value" [ 3.11017e-11 -2.40161e-11 5.43903e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.11262 0.0410701 -0.0158461 ] [ 1.41877 1.4243 1.25044 ] [ 0.19719 2.45185 3.01922 ] [ 1.59796 4.1675 4.07229 ] [ 3.2205 -0.170535 2.05026 ] [ 3.94627 1.40202 3.6633 ] [ 2.60901 3.00439 -0.668036 ] [ 3.72698 4.31381 0.563179 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1262e-11 4.10701e-12 -1.58461e-12 ] [ 1.41877e-10 1.4243e-10 1.25044e-10 ] [ 1.9719e-11 2.45185e-10 3.01922e-10 ] [ 1.59796e-10 4.1675e-10 4.07229e-10 ] [ 3.2205e-10 -1.70535e-11 2.05026e-10 ] [ 3.94627e-10 1.40202e-10 3.6633e-10 ] [ 2.60901e-10 3.00439e-10 -6.68036e-11 ] [ 3.726980000000001e-10 4.31381e-10 5.63179e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.071019100000002 6.657821500000002 -6.813914900000002 ] [ 1.3979281000000001 0.16780150000000002 -0.4396613000000001 ] [ 8.166038900000002 4.296787800000001 -4.827572400000001 ] [ -1.7092641000000004 0.40391120000000014 -4.147686400000001 ] [ -8.110315900000002 3.436322800000001 7.839087900000002 ] [ -1.0992937000000003 -7.017027100000002 2.2338243000000007 ] [ -4.254266500000001 -1.3761235000000003 5.511123100000001 ] [ -0.4618459000000001 -6.569494200000002 0.6447996000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.72684486645026e-09 1.066700595275959e-08 -1.091709514890077e-08 ] [ 2.239727719379365e-09 2.688476402351713e-10 -7.044150559305352e-10 ] [ 1.308343661012335e-08 6.884212957698667e-09 -7.734623634499348e-09 ] [ -2.738542979792754e-09 6.471370815192731e-10 -6.64532618049012e-09 ] [ -1.299415852228251e-08 5.505596051681996e-09 1.255960336177617e-08 ] [ -1.761262665532729e-09 -1.124251676714003e-08 3.578981068434926e-09 ] [ -6.816086324952644e-09 -2.204792899033469e-09 8.829792585170821e-09 ] [ -7.399587033923349e-10 -1.05254900177212e-08 1.033082844221192e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.455993 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.796758387744845e-18 } }