{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46438e-10 0.0 0.0 ] "source-value" [ 5.46438 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] "source-value" [ 0.0372754 5.43203 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] "source-value" [ 0.17857 -0.0223871 5.50346 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.968234624481985e-10 2.672400162138605e-10 -8.874472324377408e-10 ] [ 7.927246280040998e-10 2.413711122767616e-10 6.490159540424852e-10 ] [ 4.967820982815936e-10 8.112169505613735e-10 7.909192953877825e-11 ] [ -3.787918838723847e-10 -4.964147191824441e-10 -7.021811410681537e-11 ] [ -7.041934749038784e-11 7.962559854940051e-10 -1.12002239506631e-10 ] [ -4.249098970314643e-10 -6.215783589759609e-10 3.296266909982054e-10 ] [ -8.94783599184384e-12 -6.679354168868639e-10 -5.5303131508464e-11 ] [ 2.903860209839098e-10 -3.301557297183936e-10 6.723598276252032e-11 ] ] "source-value" [ [ -0.434923 0.1667981 -0.553901 ] [ 0.4947798 0.150652 0.4050839 ] [ 0.310067 0.5063218 0.0493653 ] [ -0.2364233 -0.3098377 -0.0438267 ] [ -0.0439523 0.4969839 -0.0699063 ] [ -0.2652079 -0.3879587 0.2057368 ] [ -0.0055848 -0.4168925 -0.0345175 ] [ 0.1812447 -0.206067 0.0419654 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.26127e-13 1.0583e-12 3.36114e-13 ] [ 1.28417e-10 1.2786e-10 1.26313e-10 ] [ 7.944210000000001e-12 2.71348e-10 2.73185e-10 ] [ 1.57701e-10 4.05847e-10 4.12903e-10 ] [ 2.78941e-10 -1.59624e-11 2.68623e-10 ] [ 4.22148e-10 1.3448e-10 3.91745e-10 ] [ 2.73822e-10 2.68922e-10 9.39316e-13 ] [ 4.14349e-10 4.04668e-10 1.21083e-10 ] ] "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.367402450590661e-17 "source-value" 147.76164 } }