{ "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" [ [ -1.6223323999999995 0.3557369999999999 1.3587378999999995 ] [ -0.15393049999999994 -0.14056959999999993 1.4054281999999996 ] [ -0.17216809999999994 -1.7799820999999993 -3.5943024999999986 ] [ 3.382061299999999 -0.8439995999999996 2.189763399999999 ] [ -1.4831595999999996 0.3939808999999999 -0.3313683999999999 ] [ 2.1498820999999992 -1.1162139999999996 0.10247119999999997 ] [ -3.142313199999999 1.3016183999999995 -2.432823199999999 ] [ 1.0419604999999996 1.8294289999999993 1.3020933999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.599263042446353e-09 5.699535045535295e-10 2.176938097174888e-09 ] [ -2.466238483280543e-10 -2.252173267152076e-10 2.251744204253026e-09 ] [ -2.758437046675564e-10 -2.851845706062487e-09 -5.75870743358299e-09 ] [ 5.418659544972454e-09 -1.352236427084551e-09 3.508387724563517e-09 ] [ -2.376283636035079e-09 6.312269870217426e-10 -5.309107033519026e-10 ] [ 3.444490838096406e-09 -1.78837197460965e-09 1.641769609453209e-10 ] [ -5.034540744271233e-09 2.085422569683102e-09 -3.897812453579842e-09 ] [ 1.669404752897078e-09 2.931068373213522e-09 2.086183603577982e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.807964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.737068275924805e-18 } }