{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43385e-10 0.0 0.0 ] "source-value" [ 5.43385 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.31251e-12 5.415630000000001e-10 0.0 ] "source-value" [ 0.0231251 5.41563 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.581680000000001e-12 8.29392e-12 5.41654e-10 ] "source-value" [ -0.0358168 0.0829392 5.41654 ] } "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" [ [ 3.389991839033923e-09 -3.920226904504834e-09 -1.592793954073271e-09 ] [ 2.221327361760125e-09 3.249288527977605e-09 2.406981820742594e-09 ] [ 2.014922632708689e-09 -9.32450931757054e-10 -1.097915882487836e-09 ] [ -2.67465282246745e-09 1.718557769228939e-09 1.209236235624655e-09 ] [ 4.851663177807936e-11 1.499911769923943e-09 -6.138247854372615e-10 ] [ -4.200345857267334e-09 2.194454213517109e-09 -2.936619754986933e-09 ] [ 4.187384729058048e-11 -3.397345028635085e-09 1.577256205422415e-09 ] [ -8.41633632836613e-10 -4.121894157506228e-10 1.047680275413301e-09 ] ] "source-value" [ [ 2.1158665 -2.4468132 -0.9941438 ] [ 1.3864435 2.0280464 1.5023199 ] [ 1.2576158 -0.5819901 -0.6852652 ] [ -1.669387 1.0726394 0.7547459 ] [ 0.0302817 0.9361713 -0.3831193 ] [ -2.6216497 1.3696706 -1.8328939 ] [ 0.0261356 -2.120456 0.9844459 ] [ -0.5253064 -0.2572684 0.6539106 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.33361e-11 7.45448e-12 1.00028e-11 ] [ 1.34132e-10 1.25343e-10 1.22744e-10 ] [ -6.90566e-12 2.71113e-10 2.67907e-10 ] [ 1.35774e-10 4.108290000000001e-10 3.9369e-10 ] [ 2.76453e-10 -1.5077e-12 2.69424e-10 ] [ 4.18319e-10 1.35081e-10 4.129380000000001e-10 ] [ 2.74151e-10 2.8117e-10 -1.50387e-11 ] [ 4.06649e-10 4.0541e-10 1.2862e-10 ] ] "source-value" [ [ -0.133361 0.0745448 0.100028 ] [ 1.34132 1.25343 1.22744 ] [ -0.0690566 2.71113 2.67907 ] [ 1.35774 4.10829 3.9369 ] [ 2.76453 -0.015077 2.69424 ] [ 4.18319 1.35081 4.12938 ] [ 2.74151 2.8117 -0.150387 ] [ 4.06649 4.0541 1.2862 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -6.581651355702649e-18 "source-value" -41.079437 } }