{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4121331 -1.1355633 -3.0468041 ] [ -3.0651998 0.5690162 2.8652961 ] [ 1.1578214 0.1734348 -3.2024306 ] [ -2.3978417 3.672995 -0.7226054 ] [ -0.1465346 -1.3190426 2.4465185 ] [ -1.5902405 0.1499008 3.1774048 ] [ 4.3244994 -0.9853962 -2.4337004 ] [ 0.3053628 -1.1253447 0.9163212 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.262486656917985e-09 -1.819372985687932e-09 -4.881518337395398e-09 ] [ -4.910991498101473e-09 9.116644600074706e-10 4.590710460911327e-09 ] [ 1.855034393425167e-09 2.778731840824632e-10 -5.1308594793266e-09 ] [ -3.841765943770837e-09 5.884786765798829e-09 -1.157741487482224e-09 ] [ -2.347743121925363e-10 -2.113339232970608e-09 3.919754775348728e-09 ] [ -2.547846171540477e-09 2.401675591779072e-10 5.090763727319443e-09 ] [ 6.928611892427018e-09 -1.578778766872391e-09 -3.899217915036453e-09 ] [ 4.892451430528151e-10 -1.80300098353574e-09 1.468108415878841e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.909849 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.593174436426826e-18 } }