{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0060131 1.031209 -1.3108746 ] [ 0.4162071 -0.1817245 2.9641968 ] [ -0.3425162 0.7127764 -0.2214398 ] [ -0.4463101 -1.5268757 -2.6240608 ] [ -2.6708613 0.576083 0.2646851 ] [ 5.1632822 -1.2737788 0.0487406 ] [ -1.076789 2.394837 1.1049528 ] [ 1.9630004 -1.7325262 -0.2262002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.816163910638533e-09 1.652178950958547e-09 -2.100252636920552e-09 ] [ 6.668372850309676e-10 -2.911547453265696e-10 4.749166812410174e-09 ] [ -5.487714478852569e-10 1.141993683937989e-09 -3.547856704746279e-10 ] [ -7.150676078469101e-10 -2.446324549407635e-09 -4.204208865317745e-09 ] [ -4.279191532259495e-09 9.229867142403265e-10 4.240722790941101e-10 ] [ 8.27249002743279e-09 -2.040818613430679e-09 7.809104980376449e-11 ] [ -1.725206161334611e-09 3.836951852026809e-09 1.770329543247498e-09 ] [ 3.145073347501049e-09 -2.775812972563465e-09 -3.624126720602842e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.40014 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.671727668104691e-18 } }