{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.16528949999999998 6.055762999999999 -2.0223537999999994 ] [ -0.36572399999999994 -6.8339878999999994 -0.23605659999999998 ] [ -2.3000452999999994 4.757908199999999 1.4380154999999997 ] [ -0.9096794999999999 -2.5689153999999994 0.5089660999999999 ] [ -0.9348375999999999 0.9786764999999998 -2.9053686999999995 ] [ -0.8702980999999999 -0.7305254999999999 6.172766199999999 ] [ 7.609059299999999 3.8371047999999996 -5.214533499999999 ] [ -2.3937642999999995 -5.496023699999999 2.2585645999999997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.648229725637216e-10 9.702401899705668e-09 -3.240167977346038e-09 ] [ -5.859544424654591e-10 -1.094925564021009e-08 -3.782043657055372e-10 ] [ -3.685078806440922e-09 7.62300928195261e-09 2.303954814448022e-09 ] [ -1.457467227321033e-09 -4.11585619469308e-09 8.154535861997547e-10 ] [ -1.497774946964782e-09 1.568012607626371e-09 -4.654913805944088e-09 ] [ -1.39437126894666e-09 -1.17043087699823e-09 9.889861691304454e-09 ] [ 1.219105691674081e-08 6.147719602119459e-09 -8.354603662078395e-09 ] [ -3.835233197165677e-09 -8.805600679502712e-09 3.618619398686503e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.658157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.348495644941587e-18 } }