{ "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" [ [ -1.7940797999999993 1.2313652999999996 2.3826913999999992 ] [ -0.9773492999999996 -0.11516119999999996 0.9001233999999997 ] [ -0.8988532999999996 -2.318454299999999 -2.888186899999999 ] [ 4.0436511999999984 -0.4240326999999998 0.7764989999999998 ] [ -0.5716730999999998 0.18673019999999996 0.42523469999999985 ] [ 1.4742532999999995 -1.4657703999999996 -1.2365576999999996 ] [ -2.780524499999999 1.1336162999999995 -1.2075500999999995 ] [ 1.5045755999999995 1.7717067999999994 0.8477461999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.874432735091392e-09 1.972864711578399e-09 3.817492487112746e-09 ] [ -1.565886211716255e-09 -1.845085837834007e-10 1.442156679196635e-09 ] [ -1.440121754653791e-09 -3.714573306456824e-09 -4.627385565804892e-09 ] [ 6.478643468686057e-09 -6.793752839919314e-10 1.244088554124366e-09 ] [ -9.15921283106345e-10 2.991747633021467e-10 6.813011003059994e-10 ] [ 2.362014189857392e-09 -2.348423085688833e-09 -1.981183853532781e-09 ] [ -4.454891384164531e-09 1.816253547781533e-09 -1.934708554604363e-09 ] [ 2.410595870406529e-09 2.838587237258909e-09 1.35823915320229e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.985498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.765512405845373e-18 } }