{ "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" [ 5.46438 0 0 ] "si-unit" "m" "si-value" [ 5.46438e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] "si-unit" "m" "si-value" [ 3.72754e-12 5.432030000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] "si-unit" "m" "si-value" [ 1.7857e-11 -2.23871e-12 5.503459999999999e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6035809 -0.4055289 -2.9058001 ] [ 2.410172 1.1203677 2.4406144 ] [ 0.5409907 0.9913959 -1.4714912 ] [ -1.1608126 -1.2979041 0.3337894 ] [ 0.2454969 2.3135562 -1.0496798 ] [ -0.7532091 -1.2704318 2.3703004 ] [ -0.2714495 -0.7715351 -1.6901509 ] [ 0.5923925 -0.6799199 1.9724179 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.569219827541423e-09 -6.497289226387411e-10 -4.655604984938302e-09 ] [ 3.861521230506778e-09 1.795026935639468e-09 3.910295332067819e-09 ] [ 8.667626516102267e-10 1.588391332936975e-09 -2.357588798352937e-09 ] [ -1.859826808850062e-09 -2.079471605060465e-09 5.347895729508595e-10 ] [ 3.933293936588755e-10 3.706725654546889e-09 -1.68177243488602e-09 ] [ -1.206774010593809e-09 -2.035456128280862e-09 3.797639885152889e-09 ] [ -4.349100426278496e-10 -1.23613549934659e-09 -2.707920257604079e-09 ] [ 9.491174138372642e-10 -1.089351767796674e-09 3.160161845827432e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.041404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.774469486960761e-18 } }