{ "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" [ [ 0.2591847 0.8119196 -1.6913852 ] [ 1.8390107 -1.6469108 -1.478354 ] [ -2.0516956 2.2453993 1.294149 ] [ -3.7490929 3.8898127 -2.9655528 ] [ -0.9067843 -0.7183826 -0.5153631 ] [ 3.3741883 -2.03323 -0.6028175 ] [ 0.7971724 -1.934715 3.9508871 ] [ 0.4380166 -0.613893 2.0084365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.152596668090618e-10 1.300838601089288e-09 -2.709897824207132e-09 ] [ 2.946419948941042e-09 -2.638641980303025e-09 -2.368584216066163e-09 ] [ -3.287178723318228e-09 3.597526262820685e-09 2.073455271631699e-09 ] [ -6.006708993587272e-09 6.232166967230924e-09 -4.751339363907979e-09 ] [ -1.452828605568493e-09 -1.150975806509518e-09 -8.257027100430125e-10 ] [ 5.406045608436897e-09 -3.257593570709184e-09 -9.658201051091041e-10 ] [ 1.277210982027026e-09 -3.099755140911072e-09 6.330018943040312e-09 ] [ 7.017799560423053e-10 -9.835650122727745e-10 3.21787000466138e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.939483 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.758139942623905e-18 } }