{ "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" [ 5.35419 0 0 ] "si-unit" "m" "si-value" [ 5.35419e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.128546 5.3923 0 ] "si-unit" "m" "si-value" [ 1.28546e-11 5.3923e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0752915 -0.0875116 5.49588 ] "si-unit" "m" "si-value" [ 7.52915e-12 -8.75116e-12 5.495879999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00225511 0.0160353 -0.067451 ] [ 1.37153 1.32836 1.3623 ] [ 0.0305896 2.71279 2.89841 ] [ 1.38735 4.02786 4.05412 ] [ 2.7178 -0.0621827 2.7228 ] [ 3.99586 1.31169 4.14487 ] [ 2.78113 2.65016 0.11239 ] [ 4.13075 3.95144 1.3393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.25511e-13 1.60353e-12 -6.7451e-12 ] [ 1.37153e-10 1.32836e-10 1.3623e-10 ] [ 3.05896e-12 2.71279e-10 2.89841e-10 ] [ 1.38735e-10 4.027860000000001e-10 4.05412e-10 ] [ 2.7178e-10 -6.21827e-12 2.7228e-10 ] [ 3.99586e-10 1.31169e-10 4.14487e-10 ] [ 2.78113e-10 2.65016e-10 1.1239e-11 ] [ 4.13075e-10 3.95144e-10 1.3393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.3372884999999997 0.5737541999999998 1.2658949999999995 ] [ -0.2727298999999999 -0.12765369999999995 0.9446323999999997 ] [ -0.4455182999999998 -1.4605714999999995 -2.556083299999999 ] [ 2.127569499999999 0.25892569999999987 0.49570489999999984 ] [ -0.9484854999999996 0.20308229999999994 -0.09441339999999997 ] [ 1.4960469999999995 -0.9979814999999996 -0.2637037999999999 ] [ -1.6516136999999995 0.19499599999999995 -0.7000402999999997 ] [ 1.0320194999999996 1.3554485999999994 0.9080084999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.1425723699647e-09 9.19255565325807e-10 2.028187373387615e-09 ] [ -4.369614695731218e-10 -2.045237736986169e-10 1.513467946530193e-09 ] [ -7.137990043985604e-10 -2.340093510306786e-09 -4.095296904077311e-09 ] [ 3.408742112027144e-09 4.148447030642744e-10 7.942068015960017e-10 ] [ -1.519641293267798e-09 3.253737131582917e-10 -1.512669421702387e-10 ] [ 2.396931527017977e-09 -1.598942627290915e-09 -4.225000631761188e-10 ] [ -2.646176856732985e-09 3.124180323495167e-10 -1.121588202277818e-09 ] [ 1.653477515109705e-09 2.17166805761609e-09 1.454789990187676e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -37.102043 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.94440258785163e-18 } }