{ "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" [ 5.46847 0 0 ] "si-unit" "m" "si-value" [ 5.46847e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0752926 5.44594 0 ] "si-unit" "m" "si-value" [ 7.52926e-12 5.44594e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00412544 0.201844 5.40303 ] "si-unit" "m" "si-value" [ 4.12544e-13 2.01844e-11 5.40303e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00347607 -0.00350605 -0.096896 ] [ 1.33363 1.43287 1.45525 ] [ -0.0378093 2.6958 2.61111 ] [ 1.37012 4.12622 4.01894 ] [ 2.67267 0.0858706 2.76525 ] [ 3.9434 1.3374 3.96298 ] [ 2.74102 2.68949 -0.0467586 ] [ 4.13757 3.9786 1.32692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.47607e-13 -3.50605e-13 -9.6896e-12 ] [ 1.33363e-10 1.43287e-10 1.45525e-10 ] [ -3.78093e-12 2.6958e-10 2.61111e-10 ] [ 1.37012e-10 4.12622e-10 4.01894e-10 ] [ 2.67267e-10 8.58706e-12 2.76525e-10 ] [ 3.9434e-10 1.3374e-10 3.96298e-10 ] [ 2.74102e-10 2.68949e-10 -4.67586e-12 ] [ 4.137570000000001e-10 3.9786e-10 1.32692e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.24111369999999996 -0.6852023999999999 1.1615844999999998 ] [ 0.4105501999999999 -0.9961966999999999 -2.0802051999999995 ] [ -0.22414749999999997 0.35693569999999997 1.8701597999999997 ] [ -0.5697762999999999 0.37811949999999994 -0.34024589999999993 ] [ -0.38883709999999994 -1.9587248999999998 -1.5957985999999997 ] [ 1.5909727999999999 1.9257508999999997 1.1085608999999998 ] [ -0.08099399999999998 -0.9086362999999998 0.47540269999999996 ] [ -0.49665439999999994 1.8879540999999997 -0.5994581999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.863067330945849e-10 -1.09781526579605e-09 1.861063528983657e-09 ] [ 6.577739321047641e-10 -1.596083062458111e-09 -3.332856137906587e-09 ] [ -3.59123884110768e-10 5.718740336688824e-10 2.996326308720003e-09 ] [ -9.128822669459269e-10 6.058142227685855e-10 -5.451340263030546e-10 ] [ -6.229857109196716e-10 -3.138223241358817e-09 -2.55675120842537e-09 ] [ 2.549019424488714e-09 3.085393069464558e-09 1.776110356713006e-09 ] [ -1.297666932250752e-10 -1.455795836670215e-09 7.616790914051961e-10 ] [ -7.957280682974514e-10 3.024835920163505e-09 -9.604379131868505e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -21.893575 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.507737401073136e-18 } }