{ "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" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9597884 0.2620935 0.5733348 ] [ -0.3530159 0.1967733 -0.5798716 ] [ -0.7250029 -0.498729 -1.7234467 ] [ -0.2336097 2.2615925 -1.9013088 ] [ -0.5974413 -1.0693113 -0.296217 ] [ 0.266429 0.2365044 0.7588569 ] [ -0.0390471 -2.1158337 1.2342505 ] [ 0.7218995 0.7269103 1.9344019 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.537750535395039e-09 4.199200781636448e-10 9.185836124510439e-10 ] [ -5.655938217506708e-10 3.152655808576646e-10 -9.290567205858893e-10 ] [ -1.1615826963922e-09 -7.990519439149631e-10 -2.761266009934912e-09 ] [ -3.742839997321018e-10 3.623470629276624e-09 -3.046232508281303e-09 ] [ -9.57206483160359e-10 -1.713225565217255e-09 -4.745919520835136e-10 ] [ 4.268663149031232e-10 3.789218203963315e-10 1.215822783712763e-09 ] [ -6.256035073003968e-11 -3.389939287640761e-09 1.977487295310711e-09 ] [ 1.15661050146721e-09 1.164638688078714e-09 3.099253499411099e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.258106 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.809188974768821e-18 } }