{ "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" [ [ -0.44550889999999993 -0.21947809999999998 0.17479489999999998 ] [ 0.8428537999999999 0.9640128999999998 -2.6833910999999997 ] [ -3.3580175999999997 0.07127119999999999 -1.9653181999999998 ] [ 0.19187079999999998 3.4777232999999996 0.15896989999999997 ] [ 0.15053709999999998 0.37392739999999997 2.4407457999999997 ] [ -1.0290022999999997 -0.38553119999999996 -0.16027589999999997 ] [ 2.2586866999999997 -2.7113352999999996 2.6632996999999996 ] [ 1.3885804999999998 -1.5705900999999998 -0.6288249999999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.137839439383249e-10 -3.516426805976045e-10 2.800523022150739e-10 ] [ 1.350400653112439e-09 1.544518930529608e-09 -4.299266484882794e-09 ] [ -5.380137290954926e-09 1.14189050376361e-10 -3.148786872472738e-09 ] [ 3.074109099741926e-10 5.571926964871425e-09 2.546978571909139e-10 ] [ 2.411870221830316e-10 5.990977381565298e-10 3.910505858075792e-09 ] [ -1.648643427809427e-09 -6.176890752289688e-10 -2.567902998576787e-10 ] [ 3.618815024451903e-09 -4.344038028809754e-09 4.267076513523653e-09 ] [ 2.224751213198774e-09 -2.516362739079934e-09 -1.00748871357456e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.682947 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.71703834446455e-18 } }