{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.2646948 0.8736784 -0.8960832 ] [ 1.0679073 -0.1283327 3.9351552 ] [ -0.7312657 0.571064 -0.3666564 ] [ 0.8585103 -2.2623096 -3.2216833 ] [ -4.9576198 1.2459645 0.8026619 ] [ 8.4939314 -3.2425035 -2.7066863 ] [ -3.7345639 5.7662252 3.7708158 ] [ 3.2677952 -2.8237862 -1.3175238 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.832794303407332e-09 1.399787106577951e-09 -1.43568355333165e-09 ] [ 1.710976109241652e-09 -2.056116516241401e-10 6.304813660659548e-09 ] [ -1.171616808132947e-09 9.149453897805313e-10 -5.874483119466932e-10 ] [ 1.375485131375994e-09 -3.6246195501314e-09 -5.161705662881793e-09 ] [ -7.942982538375172e-09 1.996255192246762e-09 1.286006130586908e-09 ] [ 1.360877830775901e-08 -5.195063300562173e-09 -4.336589509699655e-09 ] [ -5.98343096946367e-09 9.238511205707805e-09 6.041512916103248e-09 ] [ 5.23558507100246e-09 -4.524204231777673e-09 -2.110905829707575e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.591784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.542214759656351e-18 } }