{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 73.956011 27.0598358 -31.5723221 ] [ 113.0072672 73.4570051 -90.2467641 ] [ 157.7067592 -164.2010795 13.8446168 ] [ -39.4140502 113.2130794 52.8545223 ] [ -215.9245244 106.0231123 -88.5166304 ] [ -73.1175334 -47.1938027 177.0387753 ] [ -16.2139294 -108.3581504 -33.4021979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.18490592768047e-07 4.335463663863669e-08 -5.058443674974181e-08 ] [ 1.810576029800346e-07 1.176910971748388e-07 -1.4459125673513e-07 ] [ 2.526740846141045e-07 -2.630791328524764e-07 2.218152154364385e-08 ] [ -6.314827028174301e-08 1.813873504778667e-07 8.468228063029192e-08 ] [ -3.459492277012428e-07 1.69867753191018e-07 -1.418192769472941e-07 ] [ -1.171472035491946e-07 -7.56128079555461e-08 2.836473890976363e-07 ] [ -2.597757883000564e-08 -1.736088966743377e-07 -5.351622099962386e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 43.30327842363283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.937950086594088e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.570546 2.153895 2.543093 ] [ 2.524346 2.661693 4.212043 ] [ 2.241813 4.238266 2.673997 ] [ 3.729345 1.325386 1.859362 ] [ 4.629957 2.667135 3.458757 ] [ 3.970969 3.734581 1.387215 ] [ 4.050613 4.976756 3.428708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.570546e-10 2.153895e-10 2.543093e-10 ] [ 2.524346e-10 2.661693e-10 4.212043000000001e-10 ] [ 2.241813e-10 4.238266e-10 2.673997e-10 ] [ 3.729345e-10 1.325386e-10 1.859362e-10 ] [ 4.629957e-10 2.667135e-10 3.458757e-10 ] [ 3.970969e-10 3.734581e-10 1.387215e-10 ] [ 4.050613e-10 4.976756e-10 3.428708e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 73.956011 27.0598358 -31.5723221 ] [ 113.0072672 73.4570051 -90.2467641 ] [ 157.7067592 -164.2010795 13.8446168 ] [ -39.4140502 113.2130794 52.8545223 ] [ -215.9245244 106.0231123 -88.5166304 ] [ -73.1175334 -47.1938027 177.0387753 ] [ -16.2139294 -108.3581504 -33.4021979 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.18490592768047e-07 4.335463663863669e-08 -5.058443674974181e-08 ] [ 1.810576029800346e-07 1.176910971748388e-07 -1.4459125673513e-07 ] [ 2.526740846141045e-07 -2.630791328524764e-07 2.218152154364385e-08 ] [ -6.314827028174301e-08 1.813873504778667e-07 8.468228063029192e-08 ] [ -3.459492277012428e-07 1.69867753191018e-07 -1.418192769472941e-07 ] [ -1.171472035491946e-07 -7.56128079555461e-08 2.836473890976363e-07 ] [ -2.597757883000564e-08 -1.736088966743377e-07 -5.351622099962386e-08 ] ] } "relaxed-potential-energy" { "source-value" 43.30327842363283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.937950086594088e-18 } }