{ "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" [ [ 0.5094065 0.6220131 0.2703167 ] [ 0.4530106 0.160144 2.650194 ] [ 0.6482707 2.949508 2.588273 ] [ 2.962565 0.672996 2.425796 ] [ 1.742585 2.553059 0.6145101 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.094065e-11 6.220131e-11 2.703167e-11 ] [ 4.530106e-11 1.60144e-11 2.650194e-10 ] [ 6.482707e-11 2.949508e-10 2.588273e-10 ] [ 2.962565e-10 6.72996e-11 2.425796e-10 ] [ 1.742585e-10 2.553059e-10 6.145100999999999e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4876237 0.2821543 1.7093654 ] [ 2.0795681 3.057409 -1.3191221 ] [ 0.3154128 -3.2224321 -0.2299917 ] [ -3.7311779 1.6282159 -1.5697061 ] [ 0.8485733 -1.7453471 1.4094545 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.812592983246257e-10 4.520610266426262e-10 2.738705302848063e-09 ] [ 3.331835418631775e-09 4.898509260381306e-09 -2.113466606013011e-09 ] [ 5.053470182245151e-10 -5.162905415271551e-09 -3.684873277539378e-10 ] [ -5.978006048677189e-09 2.60868947008728e-09 -2.514946435667267e-09 ] [ 1.359564313496272e-09 -2.796354341839661e-09 2.258195066586153e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.805041432689674 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.731158491285728e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4407461 0.645143 0.3150508 ] [ 0.5522166 0.3647962 2.678486 ] [ 0.4935105 2.7446138 2.5791274 ] [ 2.8552464 0.7848761 2.2352764 ] [ 1.9741182 2.4182911 0.7411493 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.407461e-11 6.45143e-11 3.150508000000001e-11 ] [ 5.522166e-11 3.647962e-11 2.678486e-10 ] [ 4.935105e-11 2.7446138e-10 2.5791274e-10 ] [ 2.8552464e-10 7.848761e-11 2.2352764e-10 ] [ 1.9741182e-10 2.4182911e-10 7.411493e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.9e-06 -3.2e-06 -2.6e-06 ] [ -1.4e-06 3e-07 5.5e-06 ] [ 3e-07 -4.4e-06 -2.1e-06 ] [ 2e-07 -1.6e-06 7e-07 ] [ 4.7e-06 8.8e-06 -1.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.248488872599999e-15 -5.1269652288e-15 -4.165659248399999e-15 ] [ -2.2430472876e-15 4.806529901999999e-16 8.811971486999999e-15 ] [ 4.806529901999999e-16 -7.0495771896e-15 -3.364570931399999e-15 ] [ 3.204353268e-16 -2.5634826144e-15 1.1215236438e-15 ] [ 7.530230179799999e-15 1.40991543792e-14 -2.403264951e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }