{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.2203067 2.7625909 -2.6363823 ] [ -0.5165893 1.4453491 -0.0343814 ] [ 2.047204 1.6659457 -2.7105755 ] [ 1.2670476 2.3863244 -3.2981785 ] [ -0.8387845 -2.2888358 0.9481443 ] [ -2.1490006 -1.442723 4.4960444 ] [ 3.1043705 -1.9521011 1.1430508 ] [ -0.6939411 -2.5765501 2.0922781 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.557323515053648e-09 4.426158589281031e-09 -4.223950119351178e-09 ] [ -8.276673058344162e-10 2.315704555992929e-09 -5.508507572420759e-11 ] [ 3.279982413831335e-09 2.669139274052773e-09 -4.342820730792867e-09 ] [ 2.030034058885778e-09 3.823313194824069e-09 -5.284264527461168e-09 ] [ -1.343880926861373e-09 -3.667119237822697e-09 1.519094643120286e-09 ] [ -3.44307854777198e-09 -2.311497079934382e-09 7.203457283106548e-09 ] [ 4.973749878378896e-09 -3.127610769625697e-09 1.831369283235007e-09 ] [ -1.111816215792257e-09 -4.128088366550363e-09 3.352199083649915e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -330.94936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.302393316292542e-17 } }