{ "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" [ 5.43103 0 0 ] "si-unit" "m" "si-value" [ 5.43103e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00138287 5.43667 0 ] "si-unit" "m" "si-value" [ 1.38287e-13 5.43667e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0279747 -0.147199 5.47761 ] "si-unit" "m" "si-value" [ -2.79747e-12 -1.47199e-11 5.477610000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0723979 0.065909 0.162895 ] [ 1.32756 1.26807 1.42197 ] [ -0.0160699 2.71544 2.70238 ] [ 1.33005 4.08077 4.07687 ] [ 2.7682 0.027954 2.60436 ] [ 4.1716 1.44154 4.20195 ] [ 2.84836 2.7461 0.066427 ] [ 4.17903 4.06877 1.34805 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.239790000000001e-12 6.5909e-12 1.62895e-11 ] [ 1.32756e-10 1.26807e-10 1.42197e-10 ] [ -1.60699e-12 2.71544e-10 2.70238e-10 ] [ 1.33005e-10 4.08077e-10 4.07687e-10 ] [ 2.7682e-10 2.7954e-12 2.60436e-10 ] [ 4.1716e-10 1.44154e-10 4.20195e-10 ] [ 2.84836e-10 2.7461e-10 6.6427e-12 ] [ 4.17903e-10 4.06877e-10 1.34805e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.590075 0.2188957 -3.3648216 ] [ 0.8113288 2.5846788 -0.5917722 ] [ 1.2647006 -0.2398599 0.9027286 ] [ 0.4112322 0.4170936 0.1776028 ] [ 0.3725849 -1.1464377 2.3165826 ] [ -0.1844539 -1.871107 -0.807416 ] [ -2.3014858 0.2455833 0.1080217 ] [ -1.9639818 -0.2088468 1.259074 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.54758099031856e-09 3.507095729336506e-10 -5.391038500682849e-09 ] [ 1.299892035141719e-09 4.141111945637399e-09 -9.481235836793817e-10 ] [ 2.026273733631732e-09 -3.842979240474259e-10 1.446330657847515e-09 ] [ 6.588666165601498e-10 6.682576146053069e-10 2.845510539486183e-10 ] [ 5.969468160431059e-10 -1.836795680143724e-09 3.711574481872078e-09 ] [ -2.955277261953811e-10 -2.997843890415225e-09 -1.293623038459853e-09 ] [ -3.687386741863185e-09 3.934678217189126e-10 1.730698422790714e-10 ] [ -3.146645723636701e-09 -3.346094602888934e-10 2.017258926657139e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.096203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.462813930465083e-18 } }