{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] "source-value" [ 5.36644 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] "source-value" [ -0.227231 5.37948 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] "source-value" [ -0.0350261 -0.0899265 5.39939 ] } "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" [ [ 7.850024571271681e-10 4.53646216466809e-09 -9.333861222506152e-10 ] [ -2.393170096965326e-09 1.761446274973473e-09 -8.849310140547743e-10 ] [ 4.158506136338777e-09 4.372908129992936e-09 -3.884735648218535e-09 ] [ -1.674146554823998e-09 1.905313884855871e-09 -6.337039680992658e-09 ] [ 1.000328586256205e-09 -2.34646312368044e-09 3.401547858346767e-09 ] [ -4.050429870423754e-09 -3.757794713899565e-09 5.081115858420228e-09 ] [ 6.123205979385896e-09 -3.193320332953847e-09 3.048471710326533e-09 ] [ -3.94929679711263e-09 -3.278552123738855e-09 5.089568782053907e-10 ] ] "source-value" [ [ 0.48996 2.831437 -0.5825738 ] [ -1.4936993 1.0994083 -0.5523305 ] [ 2.5955354 2.7293546 -2.4246613 ] [ -1.0449201 1.1892034 -3.9552691 ] [ 0.624356 -1.4645471 2.1230792 ] [ -2.5280795 -2.345431 3.1713831 ] [ 3.8218046 -1.9931138 1.9027064 ] [ -2.4649572 -2.0463113 0.3176659 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.66535196645988e-18 "source-value" -35.360346 } }