{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4571444 -4.1978553 1.119874 ] [ -1.250317 -0.9257238 -2.4778581 ] [ -3.7192406 5.41518 2.4233479 ] [ -2.9359247 1.6812092 0.7503076 ] [ 1.60222 -2.6246855 -1.3415097 ] [ 2.9433963 -1.7680644 -6.2185841 ] [ 3.8170104 2.4199397 5.7444224 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.324260700096435e-10 -6.72570561916137e-09 1.794235941041779e-09 ] [ -2.003228665988794e-09 -1.483173029678135e-09 -3.969966317479909e-09 ] [ -5.958880336450165e-09 8.676074793423744e-09 3.882631349444776e-09 ] [ -4.703869914769254e-09 2.693594074913872e-09 1.202125295128558e-09 ] [ 2.567039425378176e-09 -4.205209745052759e-09 -2.149335477916422e-09 ] [ 4.715840737609224e-09 -2.832751445748779e-09 -9.96327005949861e-09 ] [ 6.115524824230457e-09 3.877170811085766e-09 9.203579269279826e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.246528 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.962110084757258e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8560291 1.8872942 3.8443125 ] [ 1.9890171 3.0548348 1.5968127 ] [ 2.6453089 5.2008866 2.9889405 ] [ 0.892713 3.5450388 3.8739957 ] [ 4.6280939 1.2923887 2.2647131 ] [ 4.4894262 3.6719404 1.7400804 ] [ 4.3395049 3.8614064 4.3013851 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8560291e-10 1.8872942e-10 3.8443125e-10 ] [ 1.9890171e-10 3.0548348e-10 1.5968127e-10 ] [ 2.6453089e-10 5.200886599999999e-10 2.9889405e-10 ] [ 8.92713e-11 3.5450388e-10 3.8739957e-10 ] [ 4.6280939e-10 1.2923887e-10 2.2647131e-10 ] [ 4.4894262e-10 3.6719404e-10 1.7400804e-10 ] [ 4.3395049e-10 3.8614064e-10 4.3013851e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 -4.3e-06 -3.27e-05 ] [ 1.56e-05 -1.63e-05 -1.9e-05 ] [ -2.01e-05 -3.2e-06 6.5e-06 ] [ 1.83e-05 2.24e-05 1.02e-05 ] [ -1.71e-05 1.46e-05 1.96e-05 ] [ -2e-05 -7.5e-06 2.49e-05 ] [ 9.9e-06 -5.7e-06 -9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146916671872e-14 -6.889359469440001e-15 -5.239117550016001e-14 ] [ 2.499395528448e-14 -2.611547891904e-14 -3.04413557952e-14 ] [ -3.220375007808e-14 -5.126965186560001e-15 1.04141480352e-14 ] [ 2.931983216064e-14 3.588875630592e-14 1.634220153216e-14 ] [ -2.739722021568e-14 2.339177866368e-14 3.140266176767999e-14 ] [ -3.2043532416e-14 -1.2016324656e-14 3.989419785791999e-14 ] [ 1.586154854592e-14 -9.13240673856e-15 -1.538089555968e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.543705 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650593737241206e-18 } }