{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0565752 -0.1547122 0.0880891 ] [ -0.4757955 0.283592 -0.334262 ] [ 1.0318476 0.2038296 1.3253287 ] [ -0.1537872 0.3534322 -1.2171699 ] [ 0.1802325 -2.3954696 0.0280468 ] [ 0.2511291 0.4208424 0.148909 ] [ -0.2471352 -0.0873718 -0.3095018 ] [ -0.6430665 1.3758574 0.27056 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.064346275708416e-11 -2.478762697925338e-10 1.411342965673133e-10 ] [ -7.623084263818463e-10 4.543644722459136e-10 -5.355467616218496e-10 ] [ 1.65320210094859e-09 3.265710197470157e-10 2.123410658015257e-09 ] [ -2.463942564182938e-10 5.662608078779098e-10 -1.950121157321474e-09 ] [ 2.88764297808336e-10 -3.837965388957128e-09 4.493592724825344e-11 ] [ 4.023531728225453e-10 6.742638543213619e-10 2.385785184267072e-10 ] [ -3.959542396167322e-10 -1.399850552772134e-10 -4.958765480555175e-10 ] [ -1.030306111919683e-09 2.204366559834674e-09 4.33484906523648e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.989916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.164043579175585e-18 } }