{ "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" [ 5.5612 0 0 ] "si-unit" "m" "si-value" [ 5.5612e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0917257 5.43287 0 ] "si-unit" "m" "si-value" [ -9.17257e-12 5.432870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0143429 0.0662566 5.45634 ] "si-unit" "m" "si-value" [ -1.43429e-12 6.62566e-12 5.45634e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00266051 0.00288647 -0.0538151 ] [ 1.22385 1.29926 1.47737 ] [ 0.0401458 2.69595 2.81688 ] [ 1.24418 4.12341 4.00905 ] [ 2.75119 0.03974 2.60779 ] [ 4.10264 1.45712 4.11323 ] [ 2.59294 2.8546 -0.123929 ] [ 4.00842 4.13916 1.33335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.66051e-13 2.88647e-13 -5.38151e-12 ] [ 1.22385e-10 1.29926e-10 1.47737e-10 ] [ 4.01458e-12 2.69595e-10 2.81688e-10 ] [ 1.24418e-10 4.12341e-10 4.00905e-10 ] [ 2.75119e-10 3.974e-12 2.60779e-10 ] [ 4.10264e-10 1.45712e-10 4.11323e-10 ] [ 2.59294e-10 2.8546e-10 -1.23929e-11 ] [ 4.00842e-10 4.139160000000001e-10 1.33335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9524309999999999 -0.20872969999999996 0.35362439999999995 ] [ 2.1752097999999997 1.9227374999999998 -3.1763722999999997 ] [ -3.5519059999999993 1.4448312999999997 -2.1121169999999996 ] [ 0.7283070999999999 1.6453859999999998 0.13944579999999998 ] [ 0.20296939999999997 0.45315209999999995 2.2960076999999997 ] [ -0.9389431999999999 -0.4415588999999999 -0.47407479999999996 ] [ 0.36230749999999995 -2.8822402999999994 2.6889852999999997 ] [ 1.9744863999999998 -1.9335779999999998 0.28450089999999995 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.525962693697254e-09 -3.344218481618297e-10 5.665687508922694e-10 ] [ 3.485070315607812e-09 3.080565095815574e-09 -5.089109479944838e-09 ] [ -5.690780799364403e-09 2.314874948931843e-09 -3.383984505674177e-09 ] [ 1.166876617996301e-09 2.636199003110724e-09 2.234168024694372e-10 ] [ 3.251928300969995e-10 7.260297062680312e-10 3.678609888424081e-09 ] [ -1.504352855693189e-09 -7.074553521147424e-10 -7.595515673282231e-10 ] [ 5.804806108229548e-10 -4.617858062233148e-09 4.308229416829479e-09 ] [ 3.163475974230777e-09 -3.097933491616451e-09 4.558206943319705e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.698307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.719499334875863e-18 } }