{ "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" [ [ 0.1514647 -0.1387976 5.5851983 ] [ -1.7631179 2.5379216 -4.7794956 ] [ -0.3861595 0.0499118 1.6278835 ] [ -1.1671869 0.1320591 -4.4545627 ] [ 0.3389205 -2.0086656 2.2662884 ] [ 0.2754143 0.9934212 -2.909504 ] [ -0.7714249 -4.1009569 2.5297945 ] [ 3.3220897 2.5351064 0.1343977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.426732012164858e-10 -2.223782697431501e-10 8.948474138791906e-09 ] [ -2.824826279093992e-09 4.06619865294333e-09 -7.657596109536468e-09 ] [ -6.186957227998176e-10 7.996751906204544e-11 2.608156885086077e-09 ] [ -1.870039563284027e-09 2.115820025838893e-10 -7.136996213827724e-09 ] [ 5.430105014098465e-10 -3.218237063325205e-09 3.630994290470239e-09 ] [ 4.412623524939975e-10 1.591636221247081e-09 -4.661539286924084e-09 ] [ -1.235958939482978e-09 -6.570457268088443e-09 4.053177603328425e-09 ] [ 5.322574449540486e-09 4.061688205320453e-09 2.153288528292922e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -30.449913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.878613871399399e-18 } }