{ "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" [ [ 1.601927 2.20995 2.424099 ] [ 1.129906 4.274554 2.615066 ] [ 2.801527 4.173724 0.979437 ] [ 2.35061 3.246819 4.113867 ] [ 5.119967 2.708037 1.074647 ] [ 4.165482 2.492594 3.422722 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.601927e-10 2.20995e-10 2.424099e-10 ] [ 1.129906e-10 4.274554e-10 2.615066e-10 ] [ 2.801527e-10 4.173724e-10 9.79437e-11 ] [ 2.35061e-10 3.246819e-10 4.113867e-10 ] [ 5.119967e-10 2.708037e-10 1.074647e-10 ] [ 4.165482e-10 2.492594e-10 3.422722e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -18.4916455 -89.5801292 -46.6220981 ] [ -54.1519842 85.4140716 -32.9073288 ] [ 17.7966409 6.3270277 -22.1605216 ] [ -7.8839795 21.852815 111.7275001 ] [ -19.2024267 6.8017703 12.0421002 ] [ 81.9333951 -30.8155555 -22.0796518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.962688234431125e-08 -1.435231898749411e-07 -7.46968362038758e-08 ] [ -8.676104376997718e-08 1.36848429732323e-07 -5.272335329071526e-08 ] [ 2.851336221366873e-08 1.013701594361076e-08 -3.550506990477228e-08 ] [ -1.2631527737835e-08 3.501206958012471e-08 1.790071900354527e-07 ] [ -3.076567937483772e-08 1.089763744449517e-08 1.929357156472673e-08 ] [ 1.312717711735101e-07 -4.937196298583018e-08 -3.537550220081604e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 58.441724 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.363396464347701e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7241417 1.8054044 2.181781 ] [ 1.1696992 4.8693702 2.5866351 ] [ 2.5327195 3.810409 0.3189275 ] [ 2.3703501 3.4742967 4.7617834 ] [ 5.1012181 3.3558871 1.3121172 ] [ 4.2712904 1.7903107 3.4685937 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7241417e-10 1.8054044e-10 2.181781e-10 ] [ 1.1696992e-10 4.869370199999999e-10 2.5866351e-10 ] [ 2.5327195e-10 3.810409e-10 3.189275e-11 ] [ 2.3703501e-10 3.4742967e-10 4.7617834e-10 ] [ 5.1012181e-10 3.3558871e-10 1.3121172e-10 ] [ 4.2712904e-10 1.7903107e-10 3.4685937e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.26e-05 -3.6e-06 2.65e-05 ] [ -1.02e-05 -1.13e-05 5.3e-06 ] [ 2.41e-05 4.4e-06 2.9e-06 ] [ -1.09e-05 -6.9e-06 1.5e-06 ] [ 3.34e-05 1.2e-06 -2.3e-05 ] [ -3.8e-06 1.62e-05 -1.32e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.22309582684e-14 -5.767835882399999e-15 4.2457680801e-14 ] [ -1.63422016668e-14 -1.81045959642e-14 8.4915361602e-15 ] [ 3.86124568794e-14 7.0495771896e-15 4.6463122386e-15 ] [ -1.74637253106e-14 -1.10550187746e-14 2.403264951e-15 ] [ 5.351269957559999e-14 1.9226119608e-15 -3.6850062582e-14 ] [ -6.088271209199999e-15 2.59552614708e-14 -2.11487315688e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.539142 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.489645022480803e-18 } }