{ "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" [ 5.35419 0 0 ] "si-unit" "m" "si-value" [ 5.35419e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.128546 5.3923 0 ] "si-unit" "m" "si-value" [ 1.28546e-11 5.3923e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0752915 -0.0875116 5.49588 ] "si-unit" "m" "si-value" [ 7.52915e-12 -8.75116e-12 5.495879999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00225511 0.0160353 -0.067451 ] [ 1.37153 1.32836 1.3623 ] [ 0.0305896 2.71279 2.89841 ] [ 1.38735 4.02786 4.05412 ] [ 2.7178 -0.0621827 2.7228 ] [ 3.99586 1.31169 4.14487 ] [ 2.78113 2.65016 0.11239 ] [ 4.13075 3.95144 1.3393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.25511e-13 1.60353e-12 -6.7451e-12 ] [ 1.37153e-10 1.32836e-10 1.3623e-10 ] [ 3.05896e-12 2.71279e-10 2.89841e-10 ] [ 1.38735e-10 4.027860000000001e-10 4.05412e-10 ] [ 2.7178e-10 -6.21827e-12 2.7228e-10 ] [ 3.99586e-10 1.31169e-10 4.14487e-10 ] [ 2.78113e-10 2.65016e-10 1.1239e-11 ] [ 4.13075e-10 3.95144e-10 1.3393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6933200999999998 1.0260768999999996 2.297755899999999 ] [ -1.8196342999999993 -0.07768229999999997 0.7579797999999998 ] [ 0.10925819999999996 -1.8473378999999994 -1.0089092999999996 ] [ 3.7301857999999988 -1.0482180999999995 0.5772032999999998 ] [ 0.004152799999999998 0.11425689999999995 0.07296149999999997 ] [ -0.24552369999999993 -1.3993099999999996 -1.4712372999999996 ] [ -2.921257799999999 1.9221126999999993 -0.5268815999999997 ] [ 1.8361389999999993 1.3101017999999995 -0.6988721999999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.110821264102543e-09 1.643956433867154e-09 3.681410813615639e-09 ] [ -2.915375557884945e-09 -1.244607659353781e-10 1.214417524603993e-09 ] [ 1.750509351128987e-10 -2.959761618482627e-09 -1.616450906285295e-09 ] [ 5.976416529238595e-09 -1.679430547155874e-09 9.247816403276917e-10 ] [ 6.653519125675197e-12 1.830597354532745e-10 1.168972104815909e-10 ] [ -3.933723352332256e-10 -2.241941785722539e-09 -2.357182025129248e-09 ] [ -4.680370989050242e-09 3.07956405585465e-09 -8.441573884045339e-10 ] [ 2.941819002576125e-09 2.09901449212134e-09 -1.119716708992174e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -329.46975 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.278687350598214e-17 } }