{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9549238999999998 2.1656380999999993 -1.1091143999999997 ] [ 0.4788315999999999 -0.8613739999999998 -0.7247749999999998 ] [ -0.9345211999999998 2.0215169999999993 0.03142759999999999 ] [ -0.10745279999999997 -1.1753232999999998 0.3919347999999999 ] [ -0.6417442999999999 0.21840189999999995 -0.06604379999999999 ] [ 1.2050662999999997 -1.2170102999999999 0.4367612999999999 ] [ -2.0884000999999994 0.09413709999999997 -1.0566479999999998 ] [ 1.1332966999999998 -1.2459864999999999 2.0964574999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.529956747223157e-09 3.469734732933732e-09 -1.776997161472619e-09 ] [ 7.671727948202571e-10 -1.380073284564979e-09 -1.16121756034032e-09 ] [ -1.497268018281961e-09 3.238827275949753e-09 5.035256596785407e-11 ] [ -1.721583639994982e-10 -1.883075513141504e-09 6.279487734379237e-10 ] [ -1.028187713991661e-09 3.499184181182994e-10 -1.05813832308791e-10 ] [ 1.930729052373958e-09 -1.949865449932794e-09 6.997687437302149e-10 ] [ -3.345985815096381e-09 1.508242607699116e-10 -1.692936722015078e-09 ] [ 1.815741477169791e-09 -1.996290440132419e-09 3.358895193000815e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.067825 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.778702597810577e-18 } }