{ "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" [ 5.39854 0 0 ] "si-unit" "m" "si-value" [ 5.39854e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0197648 5.43736 0 ] "si-unit" "m" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0299081 -0.213673 5.1785 ] "si-unit" "m" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4810019 7.6883613 -2.235705 ] [ -3.4559048 3.3698657 -9.4014492 ] [ -2.3706873 2.1465951 3.9237583 ] [ -0.7428334 1.0461069 -5.1328043 ] [ 10.8938119 -12.0164123 4.6220213 ] [ 3.2772364 -3.8389641 -2.5311123 ] [ -0.6900512 -1.5320747 4.8320588 ] [ -6.4305696 3.1365221 5.9232323 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.706499987403794e-10 1.23181127271235e-08 -3.581994282005664e-09 ] [ -5.5369698742705e-09 5.399120039775827e-09 -1.506278210987886e-08 ] [ -3.798259767287476e-09 3.439224483543838e-09 6.286553813929953e-09 ] [ -1.190150306629375e-09 1.676048018037564e-09 -8.22365904860171e-09 ] [ 1.745381073757283e-08 -1.925241485295356e-08 7.405294467699623e-09 ] [ 5.250711540914758e-09 -6.150698529110514e-09 -4.055288951679316e-09 ] [ -1.105583899794985e-09 -2.454654265659174e-09 7.741811639690904e-09 ] [ -1.030290827154721e-08 5.02526237924252e-09 9.490064310627411e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.933319 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.795846388474844e-18 } }