{ "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" [ [ 2.743488 1.903222 1.191758 ] [ 2.092285 1.109675 3.649357 ] [ 1.94045 3.241003 2.726585 ] [ 4.050079 0.1031898 2.277213 ] [ 5.000478 2.032764 2.106801 ] [ 4.158728 1.007331 4.48257 ] [ 3.981083 3.39009 3.613579 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.743488e-10 1.903222e-10 1.191758e-10 ] [ 2.092285e-10 1.109675e-10 3.649357e-10 ] [ 1.94045e-10 3.241003e-10 2.726585e-10 ] [ 4.050079e-10 1.031898e-11 2.277213e-10 ] [ 5.000478000000001e-10 2.032764e-10 2.106801e-10 ] [ 4.158728e-10 1.007331e-10 4.48257e-10 ] [ 3.981083e-10 3.39009e-10 3.613579e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7025075 -1.2878349 -1.1905157 ] [ -1.1644818 -0.5928457 -0.5639797 ] [ -1.7062325 1.3159594 0.6419621 ] [ -1.3971154 -1.8652584 0.1560222 ] [ 1.4706368 1.5367997 -0.8177075 ] [ 1.2006492 0.7567137 0.3326101 ] [ 0.8940362 0.1364661 1.4416085 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.125541092436656e-09 -2.063338968230306e-09 -1.907416421235346e-09 ] [ -1.865705515307101e-09 -9.498435202818106e-10 -9.035950899457978e-10 ] [ -2.733685821149136e-09 2.108399384601995e-09 1.028536668059672e-09 ] [ -2.23842563043964e-09 -2.988473400230815e-09 2.499751211657817e-10 ] [ 2.356219898648125e-09 2.462224550192454e-09 -1.310111839152816e-09 ] [ 1.923652078022223e-09 1.212388998779065e-09 5.329001260619501e-10 ] [ 1.432403897788873e-09 2.186427949517549e-10 2.309711435046557e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.784452 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.810689293293981e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8077099 1.8040502 1.172864 ] [ 1.9758704 0.9378711 3.4584765 ] [ 1.9602492 3.2424385 2.8678479 ] [ 3.889115 -0.0394453 2.3261085 ] [ 5.0269324 2.0930236 2.0899476 ] [ 4.1950444 1.2268195 4.3756786 ] [ 4.1116697 3.5225171 3.7569398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8077099e-10 1.8040502e-10 1.172864e-10 ] [ 1.9758704e-10 9.378711e-11 3.4584765e-10 ] [ 1.9602492e-10 3.2424385e-10 2.8678479e-10 ] [ 3.889115e-10 -3.944530000000001e-12 2.3261085e-10 ] [ 5.0269324e-10 2.0930236e-10 2.0899476e-10 ] [ 4.1950444e-10 1.2268195e-10 4.3756786e-10 ] [ 4.1116697e-10 3.5225171e-10 3.7569398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.21e-05 2.82e-05 -1.32e-05 ] [ 4.8e-05 1.45e-05 2.65e-05 ] [ -5.08e-05 -4.83e-05 -4.5e-05 ] [ -1.43e-05 2.71e-05 -2.33e-05 ] [ -6.83e-05 -6.07e-05 -1.07e-05 ] [ -2.6e-06 -2.56e-05 2.31e-05 ] [ 4.59e-05 6.49e-05 4.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.745163573568001e-14 4.518138070656001e-14 -2.114873139456e-14 ] [ 7.69044777984e-14 2.32315610016e-14 4.24576804512e-14 ] [ -8.139057233664001e-14 -7.738513078464e-14 -7.209794793600001e-14 ] [ -2.291112567744e-14 4.341898642368e-14 -3.733071526464e-14 ] [ -1.0942866320064e-13 -9.725212088256e-14 -1.714328984256e-14 ] [ -4.16565921408e-15 -4.101572149248001e-14 3.701027994048e-14 ] [ 7.353990689472e-14 1.0398126268992e-13 6.857315937023999e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.628085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.945854200207517e-18 } }