{ "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" [ [ -0.0412452 -0.2221083 1.6842865 ] [ -0.5540047 0.96664 -0.866829 ] [ 0.0748766 -0.2210612 -1.5836635 ] [ 1.1830375 1.0990008 0.5172856 ] [ -1.5633394 -2.8094409 -0.9712753 ] [ -0.0159952 1.3464525 1.5558577 ] [ -0.0336243 -1.3270722 -0.6359787 ] [ 0.9502947 1.1675893 0.3003168 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.60820957046568e-11 -3.558567284774622e-10 2.698524475261641e-09 ] [ -8.876133854661797e-10 1.54872802148976e-09 -1.388813169473586e-09 ] [ 1.199655389533644e-10 -3.541790893240007e-10 -2.537308655818659e-09 ] [ 1.895435039645775e-09 1.760793402507307e-09 8.287829014246703e-10 ] [ -2.504745857691579e-09 -4.50122056458393e-09 -1.55615459084134e-09 ] [ -2.56271356961568e-11 2.157254734290885e-09 2.492758852768982e-09 ] [ -5.38720677946062e-11 -2.126204070470974e-09 -1.018950212861696e-09 ] [ 1.52253996375404e-09 1.870684294568416e-09 4.811605597576511e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.36792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.826783165118127e-18 } }