{ "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" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2357311 -0.6171173 2.2688478 ] [ -0.4232447 1.8645121 -1.0353025 ] [ 0.0711507 -0.5895589 -2.212034 ] [ 1.461197 1.7548764 1.2714781 ] [ -2.305635 -3.9687457 -1.5852586 ] [ -0.0181125 1.7683474 1.7983643 ] [ -0.0327984 -2.0469521 -0.7912875 ] [ 1.4831739 1.8346379 0.2851922 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.776828572154669e-10 -9.8873091035122e-10 3.635094901313514e-09 ] [ -6.781127632175098e-10 2.987277695818712e-09 -1.658737460955792e-09 ] [ 1.139959880935546e-10 -9.445774861645652e-10 -3.544069159214707e-09 ] [ 2.341095671783097e-09 2.811621940473669e-09 2.037132485679204e-09 ] [ -3.694034493098209e-09 -6.358631574440531e-09 -2.539864266842139e-09 ] [ -2.901942404424e-11 2.833204861732466e-09 2.881297237141358e-09 ] [ -5.254882967964672e-11 -3.279578798517464e-09 -1.26778233283128e-09 ] [ 2.376306547160757e-09 2.939413951013608e-09 4.569282752745178e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.032671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.773070306117816e-18 } }