{ "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" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0564478 -0.2046803 0.4251416 ] [ 0.9729424 -0.815037 -0.7330359 ] [ -0.1221717 -0.0043036 2.224425 ] [ -1.748404 -1.9003439 1.9084729 ] [ 1.5439487 2.4449871 -0.6202532 ] [ -0.864718 0.4067941 -0.2770731 ] [ 0.364369 -0.2413265 -1.4393859 ] [ 0.9104813 0.31391 -1.4882915 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.692615966255594e-09 -3.279339913983303e-10 6.811519320495053e-10 ] [ 1.558825566665042e-09 -1.30583322648697e-09 -1.174452981187087e-09 ] [ -1.957406414633914e-10 -6.895127305274881e-12 3.56392172972304e-09 ] [ -2.801252012513203e-09 -3.044686568059893e-09 3.057710661810376e-09 ] [ 2.473678510854553e-09 3.917301169777592e-09 -9.937551760163866e-10 ] [ -1.385430963184934e-09 6.517559964993773e-10 -4.439200430725805e-10 ] [ 5.837834931442752e-10 -3.866476762794912e-10 -2.306150437289167e-09 ] [ 1.458751852535591e-09 5.02939263035328e-10 -2.384505846235363e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.268022 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.810777693106006e-18 } }