{ "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" [ [ 0.0529421 -0.1641155 0.0359097 ] [ -0.4960157 0.1958052 -0.3010911 ] [ 0.9505009 0.1975976 1.2920971 ] [ -0.1774858 0.378853 -1.1255503 ] [ 0.1900543 -2.2734565 0.0210979 ] [ 0.3120742 0.3001107 0.1531606 ] [ -0.2764042 -0.0360977 -0.331535 ] [ -0.5556658 1.4013031 0.2559113 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.482259487605569e-11 -2.629420172109024e-10 5.753368179994177e-11 ] [ -7.947047580897466e-10 3.137145136710682e-10 -4.824011211509549e-10 ] [ 1.522870320029359e-09 3.165862550461901e-10 2.07016776542348e-09 ] [ -2.843635992839847e-10 6.069894193199424e-10 -1.803330376194426e-09 ] [ 3.045005561425095e-10 -3.642478852705796e-09 3.380256212797632e-11 ] [ 4.999979871948634e-10 4.808303471919226e-10 2.453903325477005e-10 ] [ -4.428483471309274e-10 -5.783489100465216e-11 -5.31177625976928e-10 ] [ -8.902747537381286e-10 2.245135065474565e-09 4.100151018585351e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.610297240654234 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.821480652431497e-18 } }