{ "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" [ [ -2.878993 0.6587782 -0.8159922 ] [ 0.4006011 -0.0908792 2.8112194 ] [ -0.4085533 0.5169504 -0.3626472 ] [ -0.06286 -1.460947 -2.4001343 ] [ -2.6792997 0.6596734 0.5045265 ] [ 5.1300872 -1.5837511 -0.8710215 ] [ -1.4671225 3.0917742 1.7296027 ] [ 1.9661404 -1.7915989 -0.5955535 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.612655276046854e-09 1.055479030332707e-09 -1.307363625595158e-09 ] [ 6.41833716686763e-10 -1.456045295570074e-10 4.504069998619403e-09 ] [ -6.545745456106887e-10 8.282458449932084e-10 -5.810248654385818e-10 ] [ -1.00712822383488e-10 -2.340695127627897e-09 -3.845439062240174e-09 ] [ -4.292711339456454e-09 1.056913298843647e-09 8.083405628740512e-10 ] [ 8.219305774505335e-09 -2.537448985586283e-09 -1.395530283514147e-09 ] [ -2.350589369349648e-09 4.953568340032624e-09 2.771129009212556e-09 ] [ 3.15010418209036e-09 -2.870457871430997e-09 -9.541818941356128e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.303393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.656227089951438e-18 } }