{ "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" [ [ 0.5237648999999999 2.8954169999999997 -1.1394185999999997 ] [ 0.3818534999999999 -1.0649859999999998 -0.8086866999999998 ] [ -1.6279840999999995 3.2587352999999992 -0.8266845999999998 ] [ 0.18480089999999996 -1.8557556999999996 0.5813172999999999 ] [ -0.6846491999999998 0.36791549999999995 -0.17571719999999996 ] [ 1.6466762999999995 -1.8591765999999996 0.8431673999999998 ] [ -2.5284713999999995 0.7209147999999999 -1.2370786999999999 ] [ 2.1040090999999994 -2.4630641999999994 2.7631009999999994 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.391638844893462e-10 4.638969463086377e-09 -1.825549857264992e-09 ] [ 6.117967553111188e-10 -1.706295684737123e-09 -1.295658934966567e-09 ] [ -2.608318085543518e-09 5.221069554050979e-09 -1.324494749807636e-09 ] [ 2.960836839221705e-10 -2.973248420952313e-09 9.31372994999968e-10 ] [ -1.096928950726792e-09 5.894656173864269e-10 -2.815299920319047e-10 ] [ 2.638266291621573e-09 -2.978729306999563e-09 1.350903106830531e-09 ] [ -4.051057796817267e-09 1.155032847664783e-09 -1.982018587559095e-09 ] [ 3.370994217743368e-09 -3.946263909281901e-09 4.426975859582032e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.135823 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.789597126095978e-18 } }