{ "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" [ 5.40103 0 0 ] "si-unit" "m" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.134454 5.44836 0 ] "si-unit" "m" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.122267 -0.177468 5.33534 ] "si-unit" "m" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.12652 -0.101854 -0.0428595 ] [ 1.30252 1.39257 1.42794 ] [ -0.134723 2.79807 2.80389 ] [ 1.19895 4.08424 4.16214 ] [ 2.70678 0.0224968 2.81634 ] [ 3.95472 1.30925 4.22707 ] [ 2.581 2.82078 0.250931 ] [ 3.97059 4.21723 1.58759 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.2652e-11 -1.01854e-11 -4.28595e-12 ] [ 1.30252e-10 1.39257e-10 1.42794e-10 ] [ -1.34723e-11 2.79807e-10 2.80389e-10 ] [ 1.19895e-10 4.084240000000001e-10 4.16214e-10 ] [ 2.70678e-10 2.24968e-12 2.81634e-10 ] [ 3.95472e-10 1.30925e-10 4.227070000000001e-10 ] [ 2.581e-10 2.82078e-10 2.50931e-11 ] [ 3.97059e-10 4.21723e-10 1.58759e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8772428000000002 1.3234236000000001 1.8311408000000005 ] [ -1.3370567000000002 -0.9595492000000002 0.31529700000000005 ] [ 0.5244055000000001 -1.4525684000000003 0.21261450000000007 ] [ 0.9547324000000003 -0.6854042000000001 -0.4564208000000001 ] [ -1.1666757000000003 0.6665422000000001 0.17094400000000004 ] [ -0.36602700000000005 1.4563584000000003 -0.4064421000000001 ] [ 0.9248352000000002 0.46540710000000013 -0.5855378000000001 ] [ -0.4114565000000001 -0.8142096000000002 -1.0815957000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.40549790492513e-09 2.120358351334971e-09 2.933810979153009e-09 ] [ -2.142200985424e-09 -1.537367294747344e-09 5.051614820083777e-10 ] [ 8.401902319189346e-10 -2.327271130592863e-09 3.406459811430818e-10 ] [ 1.529649930400274e-09 -1.098138585038128e-09 -7.312667350068329e-10 ] [ -1.869220530595475e-09 1.067918329616598e-09 2.738824802660353e-10 ] [ -5.864399019815617e-10 2.333343379985695e-09 -6.511920303288558e-10 ] [ 1.481749335532893e-09 7.456643747743279e-10 -9.381349737546664e-10 ] [ -6.592259847761953e-10 -1.30450758555092e-09 -1.732907343697811e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.281376038775914 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.768781666458008e-18 } }