{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0510088 3.1846669 2.0803528 ] [ -5.7335571 -4.3794046 0.2541913 ] [ 0.3308685 -0.5062743 -0.3527028 ] [ 1.4053039 -0.6125034 -0.0864947 ] [ 4.9166517 -2.8288937 -2.0740786 ] [ -1.4028587 0.0883098 -0.8283498 ] [ 1.4760247 2.8114858 -3.4229492 ] [ -4.0434419 2.2426135 4.430031 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.888255009488379e-09 5.102398894253214e-09 3.333092646636475e-09 ] [ -9.1861712153248e-09 -7.016579720952116e-09 4.072593614260842e-10 ] [ 5.30109779626629e-10 -8.11140853854706e-10 -5.650921849063751e-10 ] [ 2.251545072249072e-09 -9.813386357255555e-10 -1.385797873048398e-10 ] [ 7.877344471256378e-09 -4.532387386209805e-09 -3.323040269999432e-09 ] [ -2.247627429943615e-09 1.414878981132132e-10 -1.327162694338573e-09 ] [ 2.364852285546859e-09 4.504496855582796e-09 -5.484169227608992e-09 ] [ -6.478308133116565e-09 3.593062948792959e-09 7.097692156095652e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.641849 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.710453766035627e-18 } }