{ "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" [ [ 0.0226826 -0.2456225 1.3601903 ] [ -0.4043368 0.6566959 -0.6958272 ] [ 0.0427727 -0.161572 -1.245592 ] [ 0.9965718 0.9500916 0.3419045 ] [ -1.2671925 -2.2173832 -0.8027114 ] [ -0.0191541 1.045903 1.2737832 ] [ -0.0722052 -1.0230826 -0.4753334 ] [ 0.7008616 0.9949698 0.243586 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.634153141895808e-11 -3.93530627042448e-10 2.179265098498938e-09 ] [ -6.478189678890855e-10 1.052142817955215e-09 -1.114838071956726e-09 ] [ 6.852941994849216e-11 -2.588668809758976e-10 -1.995658381455514e-09 ] [ 1.596684038908574e-09 1.522214549138465e-09 5.477913964463137e-10 ] [ -2.030266197553104e-09 -3.552639522394691e-09 -1.286085438329637e-09 ] [ -3.068825121246528e-11 1.675721334224582e-09 2.040825663007811e-09 ] [ -1.156854833401882e-10 -1.639159022867278e-09 -7.615680605653748e-10 ] [ 1.122904069936481e-09 1.594117351962052e-09 3.902677943541888e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.49650124065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.803248523357442e-18 } }