{ "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" [ 5.43808 0 0 ] "si-unit" "m" "si-value" [ 5.438080000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.036104 5.43472 0 ] "si-unit" "m" "si-value" [ -3.6104e-12 5.434720000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0778792 -0.0548884 5.50823 ] "si-unit" "m" "si-value" [ 7.78792e-12 -5.48884e-12 5.50823e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0442028 -0.0162787 0.186746 ] [ 1.46625 1.46109 1.35616 ] [ 0.0256733 2.72542 2.65757 ] [ 1.37985 4.00669 4.1027 ] [ 2.74744 0.0130417 2.60748 ] [ 4.13581 1.33996 3.97093 ] [ 2.70334 2.70384 0.0742117 ] [ 4.06803 4.03744 1.33105 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.42028e-12 -1.62787e-12 1.86746e-11 ] [ 1.46625e-10 1.46109e-10 1.35616e-10 ] [ 2.56733e-12 2.72542e-10 2.65757e-10 ] [ 1.37985e-10 4.00669e-10 4.1027e-10 ] [ 2.74744e-10 1.30417e-12 2.60748e-10 ] [ 4.13581e-10 1.33996e-10 3.97093e-10 ] [ 2.70334e-10 2.70384e-10 7.42117e-12 ] [ 4.068030000000001e-10 4.03744e-10 1.33105e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.642726 1.5997984 -5.207749 ] [ -2.8034724 -2.7556354 0.9189194 ] [ 0.4160217 0.1544517 1.167539 ] [ -0.1193839 1.2711397 0.9436719 ] [ 0.3231919 -0.7506893 2.3097128 ] [ -0.0467361 -0.9000276 2.8017876 ] [ 1.1508005 1.1406256 -4.5526904 ] [ -0.5631478 0.2403369 1.6188088 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.631937191580301e-09 2.563159594473247e-09 -8.343733694794578e-09 ] [ -4.491657936338067e-09 -4.415014613328857e-09 1.472271179079564e-09 ] [ 6.665402414854714e-10 2.474589027828153e-10 1.870603689672211e-09 ] [ -1.912740934799251e-10 2.036590309110726e-09 1.511929055885916e-09 ] [ 5.178105062119315e-10 -1.202736845944717e-09 3.700567848922506e-09 ] [ -7.487948676737088e-11 -1.442003178794734e-09 4.488958589167343e-09 ] [ 1.84378565630495e-09 1.827483669405972e-09 -7.294214120620601e-09 ] [ -9.022622392149542e-10 3.850621622955475e-10 2.593617612905303e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.359031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.665141280234245e-18 } }