{ "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" [ 5.43182 0 0 ] "si-unit" "m" "si-value" [ 5.43182e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00436542 5.42411 0 ] "si-unit" "m" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.250705 -0.013062 5.36378 ] "si-unit" "m" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6534319 0.670752 -0.4600422 ] [ -0.1946022 -1.1669773 2.1657166 ] [ -0.0210894 0.8224995 -1.4011887 ] [ 1.5294394 -0.3423966 -1.1820391 ] [ -0.0426568 0.5286278 0.6856098 ] [ -1.9527717 -1.2991601 1.4212346 ] [ 0.3476688 -0.2145271 -3.4499023 ] [ 1.9874438 1.0011818 2.2206112 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.649089934264923e-09 1.074663172754842e-09 -7.370688574213978e-10 ] [ -3.117870951962458e-10 -1.869703747064308e-09 3.469860503798465e-09 ] [ -3.378894362669952e-11 1.31778946951969e-09 -2.244951776469145e-09 ] [ 2.450432049610379e-09 -5.485798275614094e-10 -1.893835410891473e-09 ] [ -6.834372767814145e-11 8.469551022649382e-10 1.098467992551364e-09 ] [ -3.128685163499872e-09 -2.08148393889619e-09 2.27706884879204e-09 ] [ 5.57026823141591e-10 -3.437103041480237e-10 -5.527352809104148e-09 ] [ 3.184235991513912e-09 1.604070073130461e-09 3.557811348526633e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.986994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.765752043966989e-18 } }