{ "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" [ [ 0.8072049 0.1194469 0.5722114 ] [ -0.300145 0.2471297 -0.4655441 ] [ -0.5624745 -0.4421155 -1.4407013 ] [ -0.0903936 1.8296623 -1.5284054 ] [ -0.5085608 -0.9786345 -0.1953193 ] [ 0.191461 0.2566265 0.5331398 ] [ -0.105787 -1.6416692 0.9791421 ] [ 0.5686949 0.6095538 1.5454767 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.293284818975202e-09 1.913750306070355e-10 9.167837272352372e-10 ] [ -4.80885301850016e-10 3.959454276453178e-10 -7.458838729713773e-10 ] [ -9.011834936961696e-10 -7.083471177933024e-10 -2.308257940416167e-09 ] [ -1.448265125899469e-10 2.931442161019156e-09 -2.448775398984472e-09 ] [ -8.148042240153447e-10 -1.567945316208298e-09 -3.129360160510215e-10 ] [ 3.067543379949887e-10 4.111609785777312e-10 8.541841231779879e-10 ] [ -1.694894581845696e-10 -2.630244011327439e-09 1.568758581061016e-09 ] [ 9.11149673148194e-10 9.766128474797991e-10 2.476126636731135e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.246521 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.724503246113624e-18 } }