{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1397048 -0.1911085 0.2279037 ] [ 0.1971004 -0.0419734 -0.1771964 ] [ -0.2954919 -0.6652898 0.3165589 ] [ -0.6815585 0.7949387 -0.3654962 ] [ 0.6402453 0.103433 -0.0017699 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.238317643735398e-10 -3.061895707361568e-10 3.65141979933817e-10 ] [ 3.157896528303284e-10 -6.724880017548672e-11 -2.838999293699252e-10 ] [ -4.734302138157715e-10 -1.065911763616708e-09 5.071832686861651e-10 ] [ -1.091977094407517e-09 1.273632200109145e-09 -5.85589466631241e-10 ] [ 1.025786051237082e-09 1.657179344192064e-10 -2.83569240115392e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -13.657095 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.188107831704458e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1457666 2.5491804 1.6058996 ] [ 1.9389945 1.8386984 3.9360391 ] [ 1.7114455 4.809602 2.4298596 ] [ 0.1869461 3.0885526 2.965744 ] [ 3.4634948 3.5597496 3.4001627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1457666e-10 2.5491804e-10 1.6058996e-10 ] [ 1.9389945e-10 1.8386984e-10 3.9360391e-10 ] [ 1.7114455e-10 4.809602e-10 2.4298596e-10 ] [ 1.869461e-11 3.0885526e-10 2.965744e-10 ] [ 3.4634948e-10 3.5597496e-10 3.4001627e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.05e-05 5.4e-06 2.58e-05 ] [ -9e-07 -1.12e-05 -5.9e-06 ] [ 7.5e-06 7.4e-06 -6e-06 ] [ -4.29e-05 -1.37e-05 -1.35e-05 ] [ 4.68e-05 1.2e-05 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.68228545184e-14 8.65175375232e-15 4.133615681664e-14 ] [ -1.44195895872e-15 -1.794437815296e-14 -9.45284206272e-15 ] [ 1.2016324656e-14 1.185610699392e-14 -9.6130597248e-15 ] [ -6.873337703232e-14 -2.194981970496e-14 -2.16293843808e-14 ] [ 7.498186585344001e-14 1.92261194496e-14 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }