{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2007196 0.1723653 -0.4472739 ] [ 0.4173777 -0.6122649 -0.3103363 ] [ -0.7466232 0.6837396 0.3636299 ] [ -1.1273183 1.4386083 -0.8130267 ] [ -0.3579431 -0.3011435 -0.1275462 ] [ 1.4981977 -0.8886497 -0.2610734 ] [ 0.0154304 -0.5103124 0.8366937 ] [ 0.5015985 0.0176572 0.758933 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.215882504563277e-10 2.761596538971783e-10 -7.166117856740371e-10 ] [ 6.687127929832762e-10 -9.8095650851645e-10 -4.97213564445575e-10 ] [ -1.196222235586883e-09 1.095471601835144e-09 5.82599324403842e-10 ] [ -1.806163024460001e-09 2.304904584748833e-09 -1.302612370826176e-09 ] [ -5.734880663966765e-10 -4.824850752058849e-10 -2.04351539711881e-10 ] [ 2.400377328276332e-09 -1.423773773420934e-09 -4.182856977927667e-10 ] [ 2.472222612959232e-11 -8.17610596584338e-10 1.340531084910649e-09 ] [ 8.036493897283488e-10 2.828995302878976e-11 1.215944709353606e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.358954 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.742516998514265e-18 } }