{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0023458 -3.4249209 1.7804994 ] [ -0.8249771 1.3185813 -2.8359046 ] [ -0.5874218 0.5204353 2.5530471 ] [ 2.4297438 3.6003381 0.1125169 ] [ 0.8623706 0.2059464 0.8725475 ] [ -0.2291093 0.8581267 -1.0982601 ] [ -0.6482606 -3.0785069 -1.3844463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.605935006717073e-09 -5.487328194069295e-09 2.852674512028427e-09 ] [ -1.321759022315384e-09 2.112600131484071e-09 -4.543620048939176e-09 ] [ -9.411534745082534e-10 8.338292702990343e-10 4.09043237542124e-09 ] [ 3.892878710893751e-09 5.768377530795493e-09 1.802719466248915e-10 ] [ 1.381670013785268e-09 3.299625072179251e-10 1.397975205037488e-09 ] [ -3.670735640678534e-10 1.374870536424255e-09 -1.75960665577747e-09 ] [ -1.03862797750578e-09 -4.932311782151483e-09 -2.218127494613063e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.895004 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.469272324592249e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7262586 0.4589434 2.5809639 ] [ 1.4725003 2.6782588 2.7680449 ] [ 1.5015449 2.5530516 5.150611 ] [ 3.6558917 2.6716091 2.0135472 ] [ 3.1083845 0.7903592 5.0862545 ] [ 4.7747828 1.3803139 3.599111 ] [ 3.5399852 3.372151 4.3792424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7262586e-10 4.589434e-11 2.5809639e-10 ] [ 1.4725003e-10 2.6782588e-10 2.7680449e-10 ] [ 1.5015449e-10 2.5530516e-10 5.150611e-10 ] [ 3.655891700000001e-10 2.6716091e-10 2.0135472e-10 ] [ 3.1083845e-10 7.903592e-11 5.0862545e-10 ] [ 4.7747828e-10 1.3803139e-10 3.599111e-10 ] [ 3.5399852e-10 3.372151e-10 4.3792424e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.33e-05 -7.92e-05 -5.29e-05 ] [ -3.49e-05 -9e-06 1.89e-05 ] [ 1.91e-05 1.08e-05 7.8e-06 ] [ -1.79e-05 3.26e-05 -2.59e-05 ] [ -3.97e-05 -2.47e-05 -1.92e-05 ] [ 3.57e-05 1.27e-05 7.11e-05 ] [ 5.1e-05 5.68e-05 2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.130894905664e-14 -1.2689238836736e-13 -8.475514324032001e-14 ] [ -5.591596406592e-14 -1.44195895872e-14 3.028113813312e-14 ] [ 3.060157345728e-14 1.730350750464e-14 1.249697764224e-14 ] [ -2.867896151232001e-14 5.223095783807999e-14 -4.149637447872e-14 ] [ -6.360641184576e-14 -3.957376253376001e-14 -3.076179111936e-14 ] [ 5.719770536256001e-14 2.034764308416e-14 1.1391475773888e-13 ] [ 8.17110076608e-14 9.100363206143999e-14 3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }