{ "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" [ 5.42386 0 0 ] "si-unit" "m" "si-value" [ 5.423860000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00583756 5.42008 0 ] "si-unit" "m" "si-value" [ -5.83756e-13 5.42008e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.133978 0.025245 5.31918 ] "si-unit" "m" "si-value" [ 1.33978e-11 2.5245e-12 5.31918e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0601366 -0.000139309 -0.0552929 ] [ 1.41186 1.40158 1.29827 ] [ 0.0312084 2.71899 2.71348 ] [ 1.40738 4.08238 4.03102 ] [ 2.73873 -0.00499376 2.66143 ] [ 4.093 1.3473 4.02214 ] [ 2.75009 2.74892 -0.00923085 ] [ 4.15824 4.1992 1.24093 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.01366e-12 -1.39309e-14 -5.52929e-12 ] [ 1.41186e-10 1.40158e-10 1.29827e-10 ] [ 3.12084e-12 2.71899e-10 2.71348e-10 ] [ 1.40738e-10 4.08238e-10 4.03102e-10 ] [ 2.73873e-10 -4.993760000000001e-13 2.66143e-10 ] [ 4.093e-10 1.3473e-10 4.02214e-10 ] [ 2.75009e-10 2.74892e-10 -9.23085e-13 ] [ 4.158240000000001e-10 4.1992e-10 1.24093e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6321896000000005 1.7515425000000004 0.5968946000000002 ] [ -1.0854838000000002 -0.8115425000000003 0.3920380000000001 ] [ -0.005575100000000001 0.6917165000000001 -1.3421394000000002 ] [ 0.35605000000000003 -0.5320602000000001 -0.7148764000000001 ] [ 0.18070640000000002 0.7374029000000001 -0.4173363000000001 ] [ 0.3832560000000001 0.06705720000000001 -0.9781266000000002 ] [ -0.4175736000000001 0.6311309000000002 0.3777564000000001 ] [ -1.0435694000000002 -2.5352473000000004 2.0857897000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.615056039377807e-09 2.806280466957945e-09 9.563305810807764e-10 ] [ -1.739136780945529e-09 -1.300234430997945e-09 6.281141232400922e-10 ] [ -8.932294952213401e-12 1.108252013652261e-09 -2.15034438625078e-09 ] [ 5.704549905357e-10 -8.524544203213668e-10 -1.145358264278037e-09 ] [ 2.895235716942576e-10 1.181449696223839e-09 -6.686464683800144e-10 ] [ 6.140438080403041e-10 1.074374789814648e-10 -1.567131583613865e-09 ] [ -6.690266648952624e-10 1.011183180975391e-09 6.052324774239577e-10 ] [ -1.6719825086374e-09 -4.061913985471588e-09 3.34180352077787e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.606228 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.864964316047655e-18 } }