{ "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" [ [ 2.668149 2.195644 2.177876 ] [ 2.423331 4.799117 4.063095 ] [ 0.9419081 3.216694 3.792355 ] [ 4.815194 2.852634 0.7483411 ] [ 3.230766 2.566095 4.274755 ] [ 3.707939 4.705402 1.628358 ] [ 5.171828 3.316404 3.099703 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.668149e-10 2.195644e-10 2.177876e-10 ] [ 2.423331e-10 4.799117e-10 4.063095e-10 ] [ 9.419081e-11 3.216694e-10 3.792355e-10 ] [ 4.815194e-10 2.852634e-10 7.483411e-11 ] [ 3.230766e-10 2.566095e-10 4.274755e-10 ] [ 3.707939e-10 4.705402000000001e-10 1.628358e-10 ] [ 5.171828e-10 3.316404e-10 3.099703e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9696112 -7.6608094 -6.1962235 ] [ 0.3695173 7.1608657 1.6182969 ] [ -7.3130344 -0.1808598 0.004864 ] [ 2.0445649 -2.1725051 -3.8745925 ] [ 4.7529975 -3.7349286 5.3032607 ] [ -2.0025029 5.9684951 -0.9992931 ] [ 7.1180688 0.6197421 4.1436874 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.962194879105833e-09 -1.227396971708488e-08 -9.92744442895155e-09 ] [ 5.920319790411399e-10 1.147297160922863e-08 2.592797458693116e-09 ] [ -1.171677274278616e-08 -2.897693432025638e-10 7.7929870835712e-12 ] [ 3.27575408248829e-09 -3.480736879788766e-09 -6.207781518627025e-09 ] [ 7.615141473220848e-09 -5.984015283277274e-09 8.496760307547444e-09 ] [ -3.208363329464201e-09 9.56258331057936e-09 -1.601044042146757e-09 ] [ 1.140440341660591e-08 9.929363035454956e-10 6.638919076183538e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.7032548 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.93326826142538e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5510326 1.7105069 2.4189336 ] [ 2.4729054 4.7247445 3.9422514 ] [ 0.7817014 3.2919918 2.9423273 ] [ 4.1827405 3.0780605 1.1523735 ] [ 3.7933293 2.7006813 4.4867689 ] [ 3.4530408 5.2648141 1.8193244 ] [ 5.7243651 2.8811909 3.022504 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5510326e-10 1.7105069e-10 2.4189336e-10 ] [ 2.4729054e-10 4.7247445e-10 3.9422514e-10 ] [ 7.817014e-11 3.2919918e-10 2.9423273e-10 ] [ 4.1827405e-10 3.0780605e-10 1.1523735e-10 ] [ 3.7933293e-10 2.7006813e-10 4.4867689e-10 ] [ 3.4530408e-10 5.2648141e-10 1.8193244e-10 ] [ 5.7243651e-10 2.8811909e-10 3.022504e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.8e-06 -1.16e-05 -2.33e-05 ] [ -2.6e-06 -6e-07 1.47e-05 ] [ 2.17e-05 1.1e-05 1.24e-05 ] [ 7.4e-06 1.22e-05 -3.06e-05 ] [ -1.54e-05 2.8e-06 3.92e-05 ] [ -2.13e-05 -2.9e-06 -2.35e-05 ] [ 1.81e-05 -1.09e-05 1.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.249697764224e-14 -1.858524880128e-14 -3.733071526464e-14 ] [ -4.16565921408e-15 -9.6130597248e-16 2.355199632576e-14 ] [ 3.476723267136e-14 1.76239428288e-14 1.986699009792e-14 ] [ 1.185610699392e-14 1.954655477376e-14 -4.902660459647999e-14 ] [ -2.467351996032e-14 4.48609453824e-15 6.280532353535999e-14 ] [ -3.412636202304e-14 -4.646312200320001e-15 -3.76511505888e-14 ] [ 2.899939683648e-14 -1.746372516672e-14 1.794437815296e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }