{ "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" [ [ 2.689863 2.613928 1.941703 ] [ 2.080356 5.103994 1.950756 ] [ 1.651882 3.89841 3.770183 ] [ 3.604737 2.326315 3.946353 ] [ 4.359532 3.977463 2.369793 ] [ 3.455978 5.487629 3.928773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.689863e-10 2.613928e-10 1.941703e-10 ] [ 2.080356e-10 5.103994e-10 1.950756e-10 ] [ 1.651882e-10 3.89841e-10 3.770183e-10 ] [ 3.604737e-10 2.326315e-10 3.946353e-10 ] [ 4.359532e-10 3.977463000000001e-10 2.369793e-10 ] [ 3.455978e-10 5.487629000000001e-10 3.928773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6545973 -0.7229992 -1.4613208 ] [ 0.204994 0.6031918 -0.9868135 ] [ -0.8590508 -0.7540328 1.6688549 ] [ 0.227512 -0.0910664 1.0146699 ] [ 2.2346841 0.9700325 -0.0868363 ] [ -0.1535421 -0.0051259 -0.1485543 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.650957132739488e-09 -1.158372424640693e-09 -2.341294040538187e-09 ] [ 3.28436596910196e-10 9.66419807780401e-10 -1.581049531815759e-09 ] [ -1.376351119179007e-09 -1.208093733429595e-09 2.673800326316406e-09 ] [ 3.645144103546079e-10 -1.459044582224976e-10 1.625680405003116e-09 ] [ 3.580358649391319e-09 1.554163405720605e-09 -1.391270908430142e-10 ] [ -2.460015649552913e-10 -8.212597208220598e-12 -2.380102283402262e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.542112 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.8105561957411e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.995955 2.9551742 1.4554066 ] [ 1.6497944 4.7329353 2.0959934 ] [ 1.8375508 4.0557066 4.3699834 ] [ 3.1837343 2.2779609 3.7293991 ] [ 4.7607444 3.8041069 2.808087 ] [ 3.4145691 5.5818552 3.4486914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.995955e-10 2.9551742e-10 1.4554066e-10 ] [ 1.6497944e-10 4.7329353e-10 2.0959934e-10 ] [ 1.8375508e-10 4.0557066e-10 4.3699834e-10 ] [ 3.1837343e-10 2.2779609e-10 3.7293991e-10 ] [ 4.7607444e-10 3.8041069e-10 2.808087e-10 ] [ 3.4145691e-10 5.5818552e-10 3.4486914e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.79e-05 1.26e-05 2.84e-05 ] [ -1.19e-05 -2.1e-05 1.61e-05 ] [ 1.65e-05 -1.4e-06 -1.66e-05 ] [ -1.58e-05 9e-06 -2.61e-05 ] [ -3.22e-05 1.14e-05 1.46e-05 ] [ 2.54e-05 -1.07e-05 -1.64e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.86789617486e-14 2.01874255884e-14 4.550181640559999e-14 ] [ -1.90659019446e-14 -3.364570931399999e-14 2.579504380739999e-14 ] [ 2.6435914461e-14 -2.2430472876e-15 -2.65961321244e-14 ] [ -2.53143908172e-14 1.4419589706e-14 -4.18168101474e-14 ] [ -5.159008761479998e-14 1.82648136276e-14 2.33917788564e-14 ] [ 4.06952865036e-14 -1.71432899838e-14 -2.62756967976e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.930693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.033031399002736e-18 } }