{ "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" [ [ 1.4039461 1.4402699 0.5637602 ] [ -4.0886605 -2.6345399 1.7677883 ] [ 0.3431325 -0.5114979 -0.3565549 ] [ 1.3949593 -0.6087571 -0.0824219 ] [ 2.4420866 -0.5709028 0.2705017 ] [ -1.414061 0.0928189 -0.8243122 ] [ 1.4888062 2.8067446 -3.4264729 ] [ -1.5702093 -0.0141357 2.0877115 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.249369618283339e-09 2.307566761421954e-09 9.032434121775322e-10 ] [ -6.550756263488438e-09 -4.22099823434477e-09 2.832309084783777e-09 ] [ 5.497588693366561e-10 -8.195099769682962e-10 -5.71263924811682e-10 ] [ 2.234971177427533e-09 -9.753363933660077e-10 -1.320544412219155e-10 ] [ 3.912654056488961e-09 -9.146871189092583e-10 4.333914996266553e-10 ] [ -2.265575474585069e-09 1.487122715483731e-10 -1.320693735080214e-09 ] [ 2.385330486542089e-09 4.496900578676648e-09 -5.489814772184776e-09 ] [ -2.515752630222734e-09 -2.264788805864256e-11 3.3448825562753e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.784466 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.73330348130125e-18 } }