{ "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" [ [ 2.464863 1.11645 1.673921 ] [ 1.905798 2.509771 3.967609 ] [ 1.228636 3.135192 1.685921 ] [ 4.446536 2.449344 1.565667 ] [ 4.18286 2.007242 3.638636 ] [ 3.206224 4.029955 3.010958 ] [ 5.270591 3.951163 3.865389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.464863e-10 1.11645e-10 1.673921e-10 ] [ 1.905798e-10 2.509771000000001e-10 3.967609e-10 ] [ 1.228636e-10 3.135192e-10 1.685921e-10 ] [ 4.446536e-10 2.449344e-10 1.565667e-10 ] [ 4.18286e-10 2.007242e-10 3.638636e-10 ] [ 3.206224e-10 4.029955e-10 3.010958e-10 ] [ 5.270591e-10 3.951163e-10 3.865389e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.164711 -4.8750837 -4.7469464 ] [ -4.9826393 -1.5393008 6.1930978 ] [ -3.6023052 0.7102755 -3.1513457 ] [ 2.917382 -2.757919 -9.3523141 ] [ 5.2483429 -9.2359817 7.5992 ] [ -3.5594631 13.0365287 -1.2444819 ] [ 6.1433938 4.661481 4.7027903 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.468249354988589e-09 -7.810745128583161e-09 -7.605446542270725e-09 ] [ -7.983068196339277e-09 -2.466231754138737e-09 9.922436505487916e-09 ] [ -5.771529172426268e-09 1.13798680042703e-09 -5.04901240459861e-09 ] [ 4.674161234342745e-09 -4.418673343860115e-09 -1.498405900139819e-08 ] [ 8.408772292321672e-09 -1.479767394987664e-08 1.217526057678336e-08 ] [ -5.702888561420293e-09 2.088682149952822e-08 -1.993879805188763e-09 ] [ 9.84280191872767e-09 7.468515876503405e-09 7.534700671185018e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.8377039 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.944326224532981e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2052025 1.4633401 0.968304 ] [ 2.05721 1.9983447 4.3173357 ] [ 1.4437343 3.2278027 2.3929953 ] [ 4.4432916 2.0513295 1.5744787 ] [ 4.3951995 1.8508359 3.9963044 ] [ 3.549881 4.3789971 2.0100398 ] [ 4.6109891 4.2284669 4.1486431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2052025e-10 1.4633401e-10 9.683040000000001e-11 ] [ 2.05721e-10 1.9983447e-10 4.3173357e-10 ] [ 1.4437343e-10 3.2278027e-10 2.3929953e-10 ] [ 4.4432916e-10 2.0513295e-10 1.5744787e-10 ] [ 4.3951995e-10 1.8508359e-10 3.9963044e-10 ] [ 3.549881e-10 4.378997100000001e-10 2.0100398e-10 ] [ 4.6109891e-10 4.2284669e-10 4.1486431e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 3.3e-06 -1.29e-05 ] [ -1.12e-05 -1.7e-05 -2.4e-06 ] [ -7.6e-06 9.4e-06 3.63e-05 ] [ 1.3e-05 -1.04e-05 -1.98e-05 ] [ 3.1e-06 -3.61e-05 3.11e-05 ] [ 8.2e-06 1.61e-05 -3.88e-05 ] [ -5.5e-06 3.47e-05 6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 5.28718284864e-15 -2.066807840832e-14 ] [ -1.794437815296e-14 -2.72370025536e-14 -3.84522388992e-15 ] [ -1.217654231808e-14 1.506046023552e-14 5.815901133504e-14 ] [ 2.08282960704e-14 -1.666263685632e-14 -3.172309709184e-14 ] [ 4.96674752448e-15 -5.783857601088001e-14 4.982769290688e-14 ] [ 1.313784829056e-14 2.579504359488e-14 -6.216445288704e-14 ] [ -8.8119714144e-15 5.559552874176001e-14 1.04141480352e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.906007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.907552606248115e-18 } }