{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3326574 0.1805652 -0.4500874 ] [ 0.6179393 -0.8759172 -0.4680631 ] [ -1.0822161 0.9114133 0.6003969 ] [ -1.6736461 2.178873 -1.3402446 ] [ -0.5213267 -0.4413761 -0.1440153 ] [ 2.1591535 -1.2638152 -0.5449953 ] [ 0.0801836 -0.8022915 1.3252771 ] [ 0.75257 0.1125485 1.0217317 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.329759134071915e-10 2.892973443535368e-10 -7.211195155378116e-10 ] [ 9.90047907690316e-10 -1.403374071158704e-09 -7.499197620576054e-10 ] [ -1.733901348358607e-09 1.460245093176832e-09 9.619418843060345e-10 ] [ -2.681476675005227e-09 3.490939409053482e-09 -2.147308581964676e-09 ] [ -8.352574574203278e-10 -7.071624742260474e-10 -2.307379485985002e-10 ] [ 3.459345286919318e-09 -2.024855183134037e-09 -8.7317873529982e-10 ] [ 1.284682903500024e-10 -1.285412694956811e-09 2.123328003195281e-09 ] [ 1.20575006944938e-09 1.80322576891749e-10 1.636994655957098e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.281127 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.812877393458651e-18 } }