{ "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" [ 5.45189 0 0 ] "si-unit" "m" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103872 5.48254 0 ] "si-unit" "m" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0133572 0.0848103 5.46172 ] "si-unit" "m" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.4150434 -8.5308645 -9.6590424 ] [ 8.5749049 8.8618568 6.3117321 ] [ -0.706069 -0.3130435 -1.2655488 ] [ 0.6441537 0.7139081 3.5384322 ] [ 0.07423 -1.1626043 -3.0717094 ] [ 0.8413129 0.1660946 0.7197046 ] [ -2.2436503 -0.4058268 0.8627861 ] [ 0.2301612 0.6704796 2.5636457 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.188020927557591e-08 -1.366795176972009e-08 -1.547549204009528e-08 ] [ 1.373851226955211e-08 1.419825989881401e-08 1.011250969068775e-08 ] [ -1.131247253791746e-09 -5.015509811255789e-10 -2.027632716546739e-09 ] [ 1.032048006844646e-09 1.143806876643335e-09 5.669193391833214e-09 ] [ 1.1892957154182e-10 -1.862697444047926e-09 -4.921421027118159e-09 ] [ 1.347931870262779e-09 2.661128871535764e-10 1.153093893502316e-09 ] [ -3.59472408552709e-09 -6.502062164109911e-10 1.382335729559987e-09 ] [ 3.687588966934008e-10 1.074226748693666e-09 4.107413238394573e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.950278 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.599651876340425e-18 } }