{ "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" [ 5.44714 0 0 ] "si-unit" "m" "si-value" [ 5.44714e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103058 5.37075 0 ] "si-unit" "m" "si-value" [ 1.03058e-11 5.37075e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0454409 0.00880856 5.43207 ] "si-unit" "m" "si-value" [ 4.54409e-12 8.808560000000001e-13 5.432070000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.092279 -0.1565 0.140236 ] [ 1.30169 1.48453 1.67094 ] [ -0.064284 2.41697 2.49469 ] [ 1.35107 4.20911 4.05148 ] [ 2.6753 0.0424873 2.71018 ] [ 4.05146 1.3988 4.09778 ] [ 2.74223 2.69898 0.420733 ] [ 4.21922 4.15138 1.78205 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.227900000000001e-12 -1.565e-11 1.40236e-11 ] [ 1.30169e-10 1.48453e-10 1.67094e-10 ] [ -6.4284e-12 2.41697e-10 2.49469e-10 ] [ 1.35107e-10 4.20911e-10 4.05148e-10 ] [ 2.6753e-10 4.24873e-12 2.71018e-10 ] [ 4.05146e-10 1.3988e-10 4.09778e-10 ] [ 2.74223e-10 2.69898e-10 4.20733e-11 ] [ 4.21922e-10 4.15138e-10 1.78205e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6286734000000002 2.6001523000000004 0.27528510000000006 ] [ 10.860459000000002 -9.379887800000002 -8.750033700000001 ] [ -10.918719900000001 8.484346900000002 9.277573300000002 ] [ 0.4875818000000001 -2.3808466000000004 -0.5304948000000002 ] [ -1.6121539000000005 2.1928938000000002 3.117191200000001 ] [ -0.07779560000000002 -1.1297143000000003 1.7253596000000004 ] [ 1.0443092000000003 1.3434568000000002 -1.5820314000000004 ] [ 0.8449928000000002 -1.7304011000000004 -3.532849400000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.007245823598847e-09 4.165903225579348e-09 4.410553512745902e-10 ] [ 1.740037350095695e-08 -1.502823693888715e-08 -1.401909942535212e-08 ] [ -1.749371775284372e-08 1.359342224593696e-08 1.486431103901831e-08 ] [ 7.811921606875816e-10 -3.81453676023117e-09 -8.499463660159722e-10 ] [ -2.582955287711542e-09 3.513403178257271e-09 4.994290863203499e-09 ] [ -1.246422915211085e-10 -1.810001839643438e-09 2.764330813592841e-09 ] [ 1.673167785126352e-09 2.152455076014782e-09 -2.534693722451494e-09 ] [ 1.353827708904331e-09 -2.772408187026603e-09 -5.660248713487309e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.768819 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.609272920982684e-18 } }