{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5107432 2.6685795 -0.7002174 ] [ -1.520028 1.0172608 -0.5474417 ] [ 2.6331407 2.8174428 -2.483333 ] [ -1.0724008 1.2793823 -3.7887852 ] [ 0.4828585 -1.5792618 1.9214943 ] [ -2.4856766 -2.4535018 3.2105234 ] [ 3.6308737 -1.8476749 1.9430956 ] [ -2.1795107 -1.9022269 0.4446639 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.183008142725786e-10 4.275535685646154e-09 -1.121871947757362e-09 ] [ -2.435353324561383e-09 1.629831471016305e-09 -8.770982929910075e-10 ] [ 4.218756468816946e-09 4.51404098460129e-09 -3.978738074261127e-09 ] [ -1.718175489887217e-09 2.049796410125332e-09 -6.070303068673052e-09 ] [ 7.736245998545568e-10 -2.530256334082525e-09 3.078573244460461e-09 ] [ -3.982492935389633e-09 -3.930943223050718e-09 5.143825532011327e-09 ] [ 5.817300955217593e-09 -2.960301527618978e-09 3.113182342299349e-09 ] [ -3.491961088323442e-09 -3.047703466636859e-09 7.12430104693749e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.416441 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.674339376214258e-18 } }