{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3240173 -0.3328553 -1.6850592 ] [ -0.1615569 -0.1381167 0.3319401 ] [ -0.1143379 -0.4603957 -0.8042008 ] [ -1.1752549 -1.1389105 4.3896489 ] [ 1.517237 0.860167 -2.2044158 ] [ -0.7250649 0.3520999 2.2767667 ] [ 0.2864581 0.0077061 -2.6880211 ] [ 0.0485023 0.8503052 0.3833412 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.191329470717682e-10 -5.332929841630602e-10 -2.699762477146733e-09 ] [ -2.588426902414746e-10 -2.212873495051878e-10 5.318266721076234e-10 ] [ -1.831895117606286e-10 -7.376352329340737e-10 -1.288471730804107e-09 ] [ -1.882965939774007e-09 -1.824735791317257e-09 7.032992899043802e-09 ] [ 2.430881669640258e-09 1.378139468737878e-09 -3.531863486380417e-09 ] [ -1.161682040913547e-09 5.641262326137365e-10 3.647782407809287e-09 ] [ 4.589564744400354e-10 1.23465333592674e-11 -4.306684598118977e-09 ] [ 7.770925175525819e-11 1.362339123208697e-09 6.141803134895207e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.759876 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.729363776193737e-18 } }