{ "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" [ [ 0.0288617 -0.1474678 1.7525059 ] [ -0.5321722 0.8979397 -0.8653108 ] [ 0.1292429 -0.0876141 -1.5454636 ] [ 1.147994 1.0023061 0.5784996 ] [ -1.4775267 -2.654288 -0.9686678 ] [ -0.185732 1.0710153 1.3395577 ] [ -0.0358673 -1.2032791 -0.5888425 ] [ 0.9251996 1.121388 0.2977213 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.624154097654337e-11 -2.362694614808102e-10 2.807823980794063e-09 ] [ -8.526338570797017e-10 1.438657994228166e-09 -1.386380733485745e-09 ] [ 2.070699527843923e-10 -1.403732626724333e-10 -2.476105648217403e-09 ] [ 1.839289147618675e-09 1.605871400305227e-09 9.268585342621517e-10 ] [ -2.367258735347775e-09 -4.252638178469991e-09 -1.55197690248177e-09 ] [ -2.975754681344256e-10 1.715955674179098e-09 2.14620802915262e-09 ] [ -5.746574951121984e-11 -1.927865642317265e-09 -9.434296868334242e-10 ] [ 1.482333168693512e-09 1.79666163644567e-09 4.77002106374183e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.381948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.829030650476132e-18 } }