{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 5.2840675 -13.2603419 -13.6393814 ] [ -13.1378338 11.8159514 15.5183171 ] [ -5.5739343 -5.5650028 7.768379 ] [ 2.7278067 1.5806293 -14.1138578 ] [ 3.7138296 4.5897751 8.9791119 ] [ 5.2529328 -4.8850147 -7.852127 ] [ 1.7331315 5.7240036 3.3395583 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.466009480978794e-09 -2.124540995103116e-08 -2.18526981812942e-08 ] [ -2.104913033573543e-08 1.893124124155958e-08 2.486308505662264e-08 ] [ -8.930427294911145e-09 -8.916117454304576e-09 1.244631531785629e-08 ] [ 4.370428156808646e-09 2.532447331475776e-09 -2.261289318275864e-08 ] [ 5.950211007777565e-09 7.353630420535012e-09 1.438612328025134e-08 ] [ 8.416126192132195e-09 -7.826656409086519e-09 -1.258049440660052e-08 ] [ 2.776782792949371e-09 9.170864820851881e-09 5.350562276140762e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7030428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.073945855086194e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4090439 1.7916454 1.4480559 ] [ 1.3653486 2.7148944 3.446216 ] [ 3.0506405 1.6284155 4.8295759 ] [ 3.6471236 3.9461162 1.0270405 ] [ 4.3947434 3.7559132 4.9673533 ] [ 3.9626934 0.3778365 2.8405935 ] [ 2.7798247 4.6906618 3.273211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4090439e-10 1.7916454e-10 1.4480559e-10 ] [ 1.3653486e-10 2.7148944e-10 3.446216e-10 ] [ 3.0506405e-10 1.6284155e-10 4.8295759e-10 ] [ 3.6471236e-10 3.9461162e-10 1.0270405e-10 ] [ 4.3947434e-10 3.7559132e-10 4.967353300000001e-10 ] [ 3.9626934e-10 3.778365e-11 2.840593500000001e-10 ] [ 2.7798247e-10 4.690661800000001e-10 3.273211e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 -4.4e-06 4e-07 ] [ -7.2e-06 -1.4e-06 -4e-06 ] [ 5.5e-06 -1.6e-06 7e-06 ] [ 3e-06 -5e-07 -1.6e-06 ] [ 4.3e-06 -5.1e-06 2.6e-06 ] [ -2.2e-06 2.6e-06 -3e-06 ] [ -4.5e-06 1.05e-05 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.7623942974e-15 -7.0495771896e-15 6.408706536e-16 ] [ -1.15356717648e-14 -2.2430472876e-15 -6.408706535999999e-15 ] [ 8.811971486999999e-15 -2.5634826144e-15 1.1215236438e-14 ] [ 4.806529901999999e-15 -8.010883169999999e-16 -2.5634826144e-15 ] [ 6.8893595262e-15 -8.1711008334e-15 4.165659248399999e-15 ] [ -3.5247885948e-15 4.165659248399999e-15 -4.806529901999999e-15 ] [ -7.209794853e-15 1.6822854657e-14 -2.403264951e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.894908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.347733336717967e-18 } }