{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7669108 -3.1273239 -0.2234267 ] [ 0.340497 1.617216 0.9184092 ] [ 1.677405 -1.2834252 2.1690813 ] [ -2.7445832 3.1454216 -4.0524273 ] [ -0.6639295 -1.1251711 1.4328313 ] [ -1.0943624 3.2011397 -1.8430244 ] [ 4.095806 -3.3337799 3.6048805 ] [ -2.3777438 0.9059228 -2.0063239 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.228726553999025e-09 -5.010525238249077e-09 -3.579690352024954e-10 ] [ 5.455363328525377e-10 2.591065665983693e-09 1.471453748567631e-09 ] [ 2.687499074613024e-09 -2.056273849985564e-09 3.475251347474471e-09 ] [ -4.39730703688045e-09 5.03952095007933e-09 -6.492704277551667e-09 ] [ -1.063732322759434e-09 -1.802722830819819e-09 2.295648810410471e-09 ] [ -1.753361851962578e-09 5.128791187254726e-09 -2.952850605243948e-09 ] [ 6.562204616532364e-09 -5.341304214672962e-09 5.775655257877815e-09 ] [ -3.809565526612151e-09 1.451448330409674e-09 -3.214485246332277e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.826152 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.259329328522716e-18 } }