{ "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" [ [ 1.5299042 -0.2941821 13.1810378 ] [ -5.6310933 2.9714094 -11.1549579 ] [ -0.4900041 0.3809094 2.6898668 ] [ -7.0133078 4.3806648 -13.0082826 ] [ -0.7632504 -1.7872828 2.0794382 ] [ 3.4294849 0.9627821 -4.4207957 ] [ 3.5234691 -11.8770025 11.059187 ] [ 5.4147973 5.2627017 -0.4254935 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.451176741303727e-09 -4.713316828778477e-10 2.111835060104107e-08 ] [ -9.022006034803522e-09 4.760722671505356e-09 -1.787221275338826e-08 ] [ -7.850731131161452e-10 6.102841353229555e-10 4.309641700026109e-09 ] [ -1.123655779163428e-08 7.018598726121508e-09 -2.084156625847944e-08 ] [ -1.222861946696248e-09 -2.863542716917963e-09 3.331627268438434e-09 ] [ 5.494640528166626e-09 1.542546971544728e-09 -7.082895515873171e-09 ] [ 5.645219816131216e-09 -1.902905573068315e-08 1.771877085645529e-08 ] [ 8.675461640430964e-09 8.431777625984416e-09 -6.817157380023649e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -23.071533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.696467077861568e-18 } }