{ "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" [ [ 1.036246 0.517989 0.7873767 ] [ 1.003677 0.2248323 2.613371 ] [ 0.7358478 1.683575 1.603856 ] [ 2.917767 0.7228741 0.0191295 ] [ 2.564023 2.34008 0.1827334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.036246e-10 5.17989e-11 7.873767e-11 ] [ 1.003677e-10 2.248323e-11 2.613371e-10 ] [ 7.358478000000001e-11 1.683575e-10 1.603856e-10 ] [ 2.917767e-10 7.228741e-11 1.91295e-12 ] [ 2.564023e-10 2.34008e-10 1.827334e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 13.9609392 -66.5458111 -62.4730263 ] [ 3.0076072 -19.9835765 28.5429041 ] [ -21.7485054 86.374005 36.0563872 ] [ 13.5849226 -40.8012285 -6.6960862 ] [ -8.8049636 40.9566111 4.5698211 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.236789039065026e-08 -1.066181427565931e-07 -1.000928221684835e-07 ] [ 4.818717940389749e-09 -3.20172190682683e-08 4.573077363875646e-08 ] [ -3.484494688922255e-08 1.383864114558623e-07 5.776870060235238e-08 ] [ 2.176544538509755e-08 -6.537077440261865e-08 -1.072831276050151e-08 ] [ -1.4107106826915e-08 6.561972477161777e-08 7.321660527658539e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 25.09921 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.021336746254957e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9910663 -0.1260705 0.6033665 ] [ 0.9364033 0.2190686 2.9528475 ] [ 0.6669297 2.0736755 1.4933993 ] [ 2.9889979 0.5930457 -0.3538078 ] [ 2.6741636 2.7296311 0.5106611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.910663e-11 -1.260705e-11 6.033665e-11 ] [ 9.364033000000001e-11 2.190686e-11 2.9528475e-10 ] [ 6.669297e-11 2.0736755e-10 1.4933993e-10 ] [ 2.9889979e-10 5.930457e-11 -3.538078e-11 ] [ 2.6741636e-10 2.7296311e-10 5.106611e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.4e-06 3.7e-06 4.7e-06 ] [ -3.3e-06 0.0 -8e-07 ] [ -5.1e-06 -1.7e-06 1.5e-06 ] [ -2e-06 2.1e-06 -4.4e-06 ] [ 4e-06 -4.1e-06 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.025393037312e-14 5.928053496960001e-15 7.53023011776e-15 ] [ -5.28718284864e-15 0.0 -1.28174129664e-15 ] [ -8.17110076608e-15 -2.72370025536e-15 2.4032649312e-15 ] [ -3.2043532416e-15 3.36457090368e-15 -7.04957713152e-15 ] [ 6.4087064832e-15 -6.568924145279999e-15 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.846255 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.21841460466351e-18 } }