{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6982176 3.2918337 -4.0573925 ] [ 0.3225428 0.5277427 0.6414906 ] [ 0.994108 1.7801507 -1.4119955 ] [ -1.2317013 -1.8735737 1.1469193 ] [ 1.2961818 0.8583452 0.8255383 ] [ -0.5767939 -2.4636104 -0.5049305 ] [ -0.9245092 1.0675251 0.6984317 ] [ -2.5780458 -3.1884133 2.6619387 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.323021156551086e-09 5.274098993701561e-09 -6.500659404909264e-09 ] [ 5.167705333673702e-10 8.455370157378682e-10 1.027781241782965e-09 ] [ 1.592736596150246e-09 2.852115833040755e-09 -2.262266178774807e-09 ] [ -1.973403026668967e-09 -3.001795979485753e-09 1.837567288404301e-09 ] [ 2.076712176266461e-09 1.3752206120159e-09 1.322658163834977e-09 ] [ -9.241257016000531e-10 -3.947138985639736e-09 -8.089878422288544e-10 ] [ -1.481227025954512e-09 1.710363757337182e-09 1.119010940965599e-09 ] [ -4.130484708111633e-09 -5.108401246707777e-09 4.264895951142745e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.651251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.872177747527263e-18 } }