{ "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" [ [ 0.7808256999999997 1.9517351999999994 -0.8337306999999998 ] [ 0.4206119999999999 -0.7772576999999998 -0.5627871999999999 ] [ -0.8380867999999998 1.8492802999999995 -0.050278799999999985 ] [ -0.12203719999999997 -1.1067774999999997 0.3288441999999999 ] [ -0.4595727999999999 0.22350539999999994 -0.12288219999999997 ] [ 0.9860073999999998 -1.1691881999999998 0.4084295999999999 ] [ -1.7334096999999995 0.2527383999999999 -0.9278459999999997 ] [ 0.9656612999999997 -1.2240359999999997 1.7602509999999996 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.251020681459794e-09 3.127024507432411e-09 -1.335783835583218e-09 ] [ 6.738947128279294e-10 -1.24530411527678e-09 -9.016844943254937e-10 ] [ -1.342763077161085e-09 2.96287366196601e-09 -8.055551788187901e-11 ] [ -1.955251487078937e-10 -1.773253034927472e-09 5.268664891256792e-10 ] [ -7.363167957155941e-10 3.580951265025523e-10 -1.968789879524697e-10 ] [ 1.579758004215794e-09 -1.873245999355235e-09 6.543763563626955e-10 ] [ -2.777228495607941e-09 4.049315556583986e-10 -1.486573168902796e-09 ] [ 1.547159958471335e-09 -1.961121862217548e-09 2.82023299893982e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.770109 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.128826615526767e-18 } }