{ "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" [ [ 0.3729624 0.1278709 5.9930521 ] [ -2.2542771 2.0717965 -5.4496992 ] [ -0.4492248 -0.0471855 1.9143178 ] [ -4.2048373 2.4024412 -7.0783719 ] [ 0.2586364 -1.8915892 2.1711692 ] [ 0.8646295 0.8433624 -2.8125514 ] [ 2.3382924 -6.1733966 5.4019134 ] [ 3.0738185 2.6667003 -0.1398301 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.97551637717458e-10 2.048717664606547e-10 9.601927961856345e-09 ] [ -3.611750066424824e-09 3.319383915355267e-09 -8.731380648632464e-09 ] [ -7.197374720435557e-10 -7.55995049407584e-11 3.06707522394129e-09 ] [ -6.736892016327796e-09 3.849135123486697e-09 -1.134080197150767e-08 ] [ 4.143811933678771e-10 -3.030659992397775e-09 3.478596532041039e-09 ] [ 1.385289170553994e-09 1.351215520141778e-09 -4.506204097878309e-09 ] [ 3.746357415874321e-09 -9.890871703446211e-09 8.654819357066238e-09 ] [ 4.924800137282524e-09 4.272524875340347e-09 -2.240325171041261e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.823623 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.695441544775316e-18 } }