{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43182e-10 0.0 0.0 ] "source-value" [ 5.43182 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -4.36542e-13 5.42411e-10 0.0 ] "source-value" [ -0.00436542 5.42411 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.50705e-11 -1.3062e-12 5.36378e-10 ] "source-value" [ 0.250705 -0.013062 5.36378 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.199390018864086e-09 1.306413534859023e-09 -1.344171230193107e-09 ] [ -4.041721239401395e-10 -2.333459217355378e-09 4.950132952922304e-09 ] [ 6.25537818058944e-12 1.318179118873868e-09 -2.900933193370558e-09 ] [ 2.957693985168626e-09 -5.235560717917824e-10 -1.802260602864718e-09 ] [ -1.90645078938599e-10 7.592016456964531e-10 7.295689084417709e-10 ] [ -3.331637522368808e-09 -2.344034544358631e-09 2.889472663784313e-09 ] [ 2.598982020667066e-10 -5.744905483083111e-10 -7.264152160249206e-09 ] [ 3.901997338913373e-09 2.391746082384758e-09 4.742342981964524e-09 ] ] "source-value" [ [ -1.9969022 0.8153992 -0.8389657 ] [ -0.2522644 -1.4564307 3.08963 ] [ 0.0039043 0.8227427 -1.8106201 ] [ 1.8460474 -0.326778 -1.1248826 ] [ -0.1189913 0.4738564 0.4553611 ] [ -2.0794446 -1.4630313 1.803467 ] [ 0.1622157 -0.3585688 -4.5339272 ] [ 2.4354352 1.4928105 2.9599377 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.36868e-13 -3.47308e-12 7.395090000000001e-12 ] [ 1.33721e-10 1.36002e-10 1.29514e-10 ] [ 8.04819e-12 2.71297e-10 2.74807e-10 ] [ 1.4297e-10 4.00589e-10 4.14244e-10 ] [ 2.76212e-10 -4.29027e-12 2.66501e-10 ] [ 4.31635e-10 1.33651e-10 3.99144e-10 ] [ 2.62716e-10 2.67896e-10 1.44482e-11 ] [ 3.97118e-10 3.97277e-10 1.25678e-10 ] ] "source-value" [ [ 0.00336868 -0.0347308 0.0739509 ] [ 1.33721 1.36002 1.29514 ] [ 0.0804819 2.71297 2.74807 ] [ 1.4297 4.00589 4.14244 ] [ 2.76212 -0.0429027 2.66501 ] [ 4.31635 1.33651 3.99144 ] [ 2.62716 2.67896 0.144482 ] [ 3.97118 3.97277 1.25678 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.730472274994635e-18 "source-value" -35.766795 } }