{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.1479012 -1.4491185 0.2113905 ] [ 0.1767724 1.0283613 -1.6445524 ] [ 0.130466 0.6785488 2.8901924 ] [ -1.921412 -4.0529761 -2.9136978 ] [ -1.2816296 0.3885216 6.0584264 ] [ -0.252098 3.406663 -4.6017591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.04349374878056e-09 -2.321743800597129e-09 3.38684919749577e-10 ] [ 2.832206088161016e-10 1.647616446169864e-09 -2.634863428668621e-09 ] [ 2.09029576731444e-10 1.087155032388739e-09 4.630598731044381e-09 ] [ -3.078441410687208e-09 -6.493583605580447e-09 -4.668258533697205e-09 ] [ -2.053396998562766e-09 6.224802293242945e-10 9.706669216888738e-09 ] [ -4.039055250781319e-10 5.458075858512341e-09 -7.372830905316868e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.144906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.26626378833264e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4711588 0.4399314 1.959847 ] [ 0.3469044 2.4991319 0.5960206 ] [ 1.2565264 2.7536979 2.8815168 ] [ 2.6969067 1.4455804 1.2382677 ] [ 2.3471874 0.5941896 3.6737741 ] [ 2.1794617 2.4717866 -0.8959098 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.711588e-11 4.399314e-11 1.959847e-10 ] [ 3.469044e-11 2.4991319e-10 5.960206e-11 ] [ 1.2565264e-10 2.7536979e-10 2.8815168e-10 ] [ 2.6969067e-10 1.4455804e-10 1.2382677e-10 ] [ 2.3471874e-10 5.941896e-11 3.6737741e-10 ] [ 2.1794617e-10 2.4717866e-10 -8.959098e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.93e-05 -7.9e-05 6.59e-05 ] [ 5.98e-05 3.7e-05 -1.87e-05 ] [ 4.68e-05 -2.78e-05 5.72e-05 ] [ 2.61e-05 0.0002257 -3.93e-05 ] [ -9.1e-05 -6.71e-05 1.18e-05 ] [ -2.23e-05 -8.89e-05 -7.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.09220090362e-14 -1.26571954086e-13 1.055834401806e-13 ] [ 9.581016271319999e-14 5.9280535458e-14 -2.99607030558e-14 ] [ 7.498186647119999e-14 -4.454051042519999e-14 9.164450346479999e-14 ] [ 4.18168101474e-14 3.616112662938e-13 -6.29655417162e-14 ] [ -1.45798073694e-13 -1.075060521414e-13 1.89056842812e-14 ] [ -3.572853893819999e-14 -1.424335027626e-13 -1.232073831546e-13 ] ] } "relaxed-potential-energy" { "source-value" -20.309927 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.254009047764571e-18 } }