{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.6207854 -10.709091 -5.0700903 ] [ -1.2008653 3.9293417 -1.9138638 ] [ -16.5464857 -4.0296202 15.4249083 ] [ 0.926122 12.1788896 -1.6051012 ] [ 22.4420145 -1.3695201 -6.835853 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.005490958413977e-09 -1.715785523021969e-08 -8.12318014400486e-09 ] [ -1.923998308389978e-09 6.295499406874528e-09 -3.066347835755447e-09 ] [ -2.651039254494152e-08 -6.45616327514342e-09 2.471342745624387e-08 ] [ 1.483811016408538e-09 1.951273218442427e-08 -2.571655616658025e-09 ] [ 3.59560709555546e-08 -2.194213085935678e-09 -1.095224385982554e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.144735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.625365724121149e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9426883 0.4095993 2.1969292 ] [ 2.5780249 2.5710592 1.0750308 ] [ 2.1472235 1.5176106 4.4474152 ] [ 2.7825929 3.6790612 3.3255194 ] [ 4.1503295 1.5586276 2.8378675 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9426883e-10 4.095993e-11 2.1969292e-10 ] [ 2.5780249e-10 2.5710592e-10 1.0750308e-10 ] [ 2.1472235e-10 1.5176106e-10 4.4474152e-10 ] [ 2.7825929e-10 3.6790612e-10 3.3255194e-10 ] [ 4.1503295e-10 1.5586276e-10 2.8378675e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.61e-05 4.96e-05 9.2e-06 ] [ 1.52e-05 -2.83e-05 5.27e-05 ] [ 4.27e-05 1.09e-05 -5.3e-05 ] [ -2.7e-06 -4.71e-05 -1.52e-05 ] [ -8.12e-05 1.5e-05 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.181680980288e-14 7.946796039168e-14 1.474002491136e-14 ] [ 2.435308463616e-14 -4.534159836864e-14 8.443470791616e-14 ] [ 6.841294170816001e-14 1.746372516672e-14 -8.49153609024e-14 ] [ -4.32587687616e-15 -7.546251883968001e-14 -2.435308463616e-14 ] [ -1.3009674160896e-13 2.4032649312e-14 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.709606 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.677174007597941e-18 } }