{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1280608999999997 2.1484534999999996 -1.0392297999999998 ] [ 0.36080709999999994 -0.6266074999999999 -0.4317586999999999 ] [ -0.7695657999999997 1.9051527999999995 0.14693169999999997 ] [ -0.38970129999999986 -1.1718653999999997 0.31603109999999995 ] [ -0.5653024999999999 0.11110989999999997 -2.0999999999999994e-06 ] [ 1.1842717999999999 -1.1858818999999998 0.31635069999999993 ] [ -2.0241007999999994 0.10380039999999997 -1.2154594999999997 ] [ 1.0755304999999997 -1.2841617999999997 1.9071365999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.807352800818606e-09 3.442201968575932e-09 -1.665029689198659e-09 ] [ 5.780767002386476e-10 -1.003935886917936e-09 -6.917536949670007e-10 ] [ -1.232980332927248e-09 3.052391275211658e-09 2.354105345943994e-10 ] [ -6.243703119553669e-10 -1.87753534660444e-09 5.063376398657068e-10 ] [ -9.057144491797919e-10 1.780176841194259e-10 -3.364570903679999e-15 ] [ 1.897412590632733e-09 -1.899992255209883e-09 5.068496955137145e-10 ] [ -3.242966979902576e-09 1.663065741096883e-10 -1.947380794429257e-09 ] [ 1.723189822057334e-09 -2.057454013284445e-09 3.055569673192001e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.041825 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.774536938596497e-18 } }