{ "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" [ [ 0.0859506 0.6105395 -1.39258 ] [ 1.4686494 -1.4173651 -1.1661793 ] [ -1.7542453 1.8739082 1.1100901 ] [ -3.2015785 3.4595436 -2.5154091 ] [ -0.8085463 -0.6524916 -0.3777723 ] [ 3.0799977 -1.8508729 -0.5794953 ] [ 0.5915316 -1.6070606 3.193495 ] [ 0.5382407 -0.4162012 1.727851 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.377080418637325e-10 9.781921129749218e-10 -2.231159118593664e-09 ] [ 2.353035732831948e-09 -2.270869226357854e-09 -1.868425210120909e-09 ] [ -2.810610806808282e-09 3.002331907565411e-09 1.778560405201534e-09 ] [ -5.129494222355933e-09 5.542799874558266e-09 -4.030129651767569e-09 ] [ -1.295433978694343e-09 -1.045406786788385e-09 -6.052579470458439e-10 ] [ 4.934700307057772e-09 -2.965425288452296e-09 -9.284538215234823e-10 ] [ 9.477380999844175e-10 -2.574794921528821e-09 5.116543027641696e-09 ] [ 8.623566659030266e-10 -6.66827832188905e-10 2.768322476425901e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.061342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.777663906707312e-18 } }