{ "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" [ [ 2.384535 1.809355 2.901981 ] [ 1.948299 3.967012 2.633856 ] [ 1.645033 3.274995 4.707865 ] [ 4.440095 1.758867 2.666287 ] [ 3.649735 2.240012 5.07701 ] [ 4.164388 4.024114 1.736165 ] [ 3.303688 4.596831 4.046686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.384535e-10 1.809355e-10 2.901981e-10 ] [ 1.948299e-10 3.967012e-10 2.633856000000001e-10 ] [ 1.645033e-10 3.274995e-10 4.707865e-10 ] [ 4.440095e-10 1.758867e-10 2.666287e-10 ] [ 3.649735e-10 2.240012e-10 5.07701e-10 ] [ 4.164388e-10 4.024114e-10 1.736165e-10 ] [ 3.303688e-10 4.596831e-10 4.046686e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -68.8132547 -9.5699051 -0.3451701 ] [ -49.6239487 -10.6254273 -74.6925914 ] [ -36.4045627 -15.5693368 34.8955569 ] [ 67.6908325 -0.4518674 -7.6899 ] [ 12.8865863 -5.5251098 5.7947316 ] [ 3.5786334 0.0798445 -0.652774 ] [ 70.6857139 41.6618019 42.6901469 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.102509878814957e-07 -1.533267821449468e-08 -5.530234644191981e-10 ] [ -7.950633043891857e-08 -1.702381120607007e-08 -1.196707236880471e-07 ] [ -5.832653924838773e-08 -2.494482742232109e-08 5.590884543497613e-08 ] [ 1.084526692739888e-07 -7.239713839816819e-10 -1.232057799628992e-08 ] [ 2.064658729178157e-08 -8.852201748912963e-09 9.284183493330978e-09 ] [ 5.733602767894015e-09 1.279249911994656e-10 -1.045859241466099e-09 ] [ 1.132509982351376e-07 6.674956498458103e-08 6.83971553016976e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.3221142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.49356734276677e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0649711 1.4712706 3.0104556 ] [ 1.7540781 4.0017936 2.2813783 ] [ 1.3449495 3.3113177 4.8816726 ] [ 4.6389463 1.6998977 2.5351517 ] [ 3.8522897 2.2580548 4.9791545 ] [ 4.3391121 4.1402822 1.831997 ] [ 3.5414263 4.7885695 4.2500402 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0649711e-10 1.4712706e-10 3.0104556e-10 ] [ 1.7540781e-10 4.0017936e-10 2.2813783e-10 ] [ 1.3449495e-10 3.3113177e-10 4.8816726e-10 ] [ 4.6389463e-10 1.6998977e-10 2.5351517e-10 ] [ 3.8522897e-10 2.2580548e-10 4.9791545e-10 ] [ 4.339112100000001e-10 4.1402822e-10 1.831997e-10 ] [ 3.5414263e-10 4.788569500000001e-10 4.2500402e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.04e-05 3.3e-06 -2e-06 ] [ 4.47e-05 -5.05e-05 -7.6e-06 ] [ 5.6e-06 4.2e-05 -2.2e-06 ] [ -7.88e-05 8.62e-05 1.07e-05 ] [ 1.28e-05 7e-07 -2.05e-05 ] [ -5.7e-06 -2.16e-05 1.17e-05 ] [ -9e-06 -6.01e-05 9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.870616927232e-14 5.28718284864e-15 -3.2043532416e-15 ] [ 7.161729494976001e-14 -8.090991935040001e-14 -1.217654231808e-14 ] [ 8.972189076479999e-15 6.72914180736e-14 -3.52478856576e-15 ] [ -1.2625151771904e-13 1.3810762471296e-13 1.714328984256e-14 ] [ 2.050786074624e-14 1.12152363456e-15 -3.28446207264e-14 ] [ -9.13240673856e-15 -3.460701500928e-14 1.874546646336e-14 ] [ -1.44195895872e-14 -9.629081491008e-14 1.554111322176e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.900855 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.989556771893079e-18 } }