{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9007265 -0.1814679 -1.2771667 ] [ -5.1464563 -13.2119503 1.7587775 ] [ -11.2095925 4.8939834 8.7485145 ] [ -3.237612 4.7147189 -2.6979511 ] [ 2.49556 -2.2688378 -8.7255197 ] [ 14.8279456 -4.0551455 8.9004349 ] [ 3.1708817 10.1086993 -6.7070895 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.443122940035011e-09 -2.907436268056723e-10 -2.046246627604287e-09 ] [ -8.24553196382887e-09 -2.116787788583155e-08 2.817872191689072e-09 ] [ -1.795974703219502e-08 7.841025786063294e-09 1.40166653986298e-08 ] [ -5.187226253621529e-09 7.553812395223893e-09 -4.322594176481644e-09 ] [ 3.998327887803648e-09 -3.635078879547306e-09 -1.397982366766983e-08 ] [ 2.375698777481423e-08 -6.497059314042327e-09 1.426006871173239e-08 ] [ 5.08031252706256e-09 1.619592168515732e-08 -1.074594199051316e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.8287571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.574740483714201e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.20819 1.6088827 1.9703919 ] [ 2.5995276 0.1149301 4.1153512 ] [ 2.2673483 2.3389929 5.1884834 ] [ 1.5848783 3.60688 2.5291331 ] [ 4.1655941 0.9384857 2.2422632 ] [ 4.8511993 1.7021598 4.6753319 ] [ 3.9777473 3.7456276 3.1548371 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.20819e-10 1.6088827e-10 1.9703919e-10 ] [ 2.5995276e-10 1.149301e-11 4.1153512e-10 ] [ 2.2673483e-10 2.3389929e-10 5.1884834e-10 ] [ 1.5848783e-10 3.60688e-10 2.5291331e-10 ] [ 4.1655941e-10 9.384857e-11 2.2422632e-10 ] [ 4.851199300000001e-10 1.7021598e-10 4.6753319e-10 ] [ 3.9777473e-10 3.7456276e-10 3.1548371e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.7019542 3.026635 -0.4173049 ] [ -1.1243448 1.1863288 0.6722008 ] [ -0.6547616 -2.3028434 -0.0031718 ] [ 1.2310579 -1.8129754 0.214253 ] [ 0.0882559 -1.1921963 1.4654831 ] [ 2.4041087 0.1561791 -0.498772 ] [ -2.6462702 0.9388722 -1.4326882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.124654608112367e-09 4.849203836695008e-09 -6.685961545252819e-10 ] [ -1.801398952278052e-09 1.900708267941719e-09 1.076984406243057e-09 ] [ -1.049043727717601e-09 -3.689561856843582e-09 -5.081783805853439e-12 ] [ 1.972372186231144e-09 -2.904706799965528e-09 3.432711475362624e-10 ] [ 1.414015396276627e-10 -1.910109039264263e-09 2.347962760997508e-09 ] [ 3.851806753001881e-09 2.502265026775853e-10 -7.991208375096575e-10 ] [ -4.23979224675974e-09 1.504239088759062e-09 -2.295419538936035e-09 ] ] } "relaxed-potential-energy" { "source-value" -16.068582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.574470640980771e-18 } }