{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.539099 2.604661 3.099024 ] [ 2.611969 4.601789 1.586924 ] [ 4.376067 2.909228 1.297188 ] [ 4.596034 1.971363 3.954157 ] [ 4.509814 4.398854 3.387028 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.539099e-10 2.604661e-10 3.099024e-10 ] [ 2.611969e-10 4.601789e-10 1.586924e-10 ] [ 4.376067e-10 2.909228e-10 1.297188e-10 ] [ 4.596034e-10 1.971363e-10 3.954157e-10 ] [ 4.509814000000001e-10 4.398854e-10 3.387028e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.0693478 -6.3941509 3.9676651 ] [ -8.4567219 9.9111559 -7.1600965 ] [ 7.1238465 -4.9388559 -12.4659129 ] [ 7.2151968 -9.8085525 8.7492078 ] [ 7.1870264 11.2304034 6.9091365 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.093940349426391e-08 -1.024455908184728e-08 6.356900262384094e-09 ] [ -1.354916211678735e-08 1.587942226808398e-08 -1.147173921497191e-08 ] [ 1.141366031246791e-08 -7.912919456480144e-09 -1.997259420530913e-08 ] [ 1.156001962743098e-08 -1.571503349938939e-08 1.4017776187681e-08 ] [ 1.151488567115239e-08 1.799308976963283e-08 1.106965697021594e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 75.155998 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.204131829084916e-17 } "relaxed-configuration-positions" { "source-value" [ [ -1.9406512 0.3799479 4.4754624 ] [ -0.3460926 8.3917305 -1.2924417 ] [ 6.5953331 1.2757578 -2.5337926 ] [ 7.5046673 -1.7254222 6.9960516 ] [ 6.8197264 8.1638811 5.6790413 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.9406512e-10 3.799479e-11 4.4754624e-10 ] [ -3.460926e-11 8.391730499999999e-10 -1.2924417e-10 ] [ 6.595333100000001e-10 1.2757578e-10 -2.5337926e-10 ] [ 7.504667300000001e-10 -1.7254222e-10 6.996051600000001e-10 ] [ 6.8197264e-10 8.1638811e-10 5.6790413e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 1.7763568e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.846037335159101e-34 } }