{ "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" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0645035 0.3355294 6.0461684 ] [ -2.3013265 3.2587827 -5.7460948 ] [ -0.7424499 0.063456 2.0696559 ] [ -5.8302688 2.4860847 -8.4017369 ] [ 1.0370135 -2.8345598 2.3577736 ] [ 0.5952004 1.083005 -3.1093636 ] [ 3.2256782 -7.0132537 5.9399072 ] [ 4.0806567 2.6209558 0.8436902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.033459996597728e-10 5.375773602710515e-10 9.687029655899743e-09 ] [ -3.687131515127491e-09 5.2211454542075e-09 -9.206258749460452e-09 ] [ -1.189535871895298e-09 1.016677196494848e-10 3.315954296080783e-09 ] [ -9.34112036433967e-09 3.983146783668582e-09 -1.346106643529267e-08 ] [ 1.661478785153981e-09 -4.541465441819524e-09 3.77756973905945e-09 ] [ 9.536161655708082e-10 1.735165291209504e-09 -4.981749665486523e-09 ] [ 5.168106198264226e-09 -1.12364711138791e-08 9.51678044556159e-09 ] [ 6.537932762250879e-09 4.19923410691016e-09 1.351740713638076e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.660548 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.59192599449162e-18 } }