{ "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" [ [ 1.247505 0.2174365 0.42208 ] [ 0.0506875 0.0915851 2.362651 ] [ 1.429891 2.603248 1.463699 ] [ 0.6097234 2.164425 2.912732 ] [ 2.744149 0.6540612 0.6213704 ] [ 2.652131 2.68783 0.0915898 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.247505e-10 2.174365e-11 4.2208e-11 ] [ 5.068750000000001e-12 9.15851e-12 2.362651e-10 ] [ 1.429891e-10 2.603248e-10 1.463699e-10 ] [ 6.097234e-11 2.164425e-10 2.912732e-10 ] [ 2.744149e-10 6.540612e-11 6.213704e-11 ] [ 2.652131e-10 2.68783e-10 9.15898e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.2647636 -6.3212266 -2.8422939 ] [ -1.7235237 -1.2352085 0.9857674 ] [ -1.2763826 2.2813615 -2.4199845 ] [ -6.6318737 -2.8446533 12.2083415 ] [ 19.7911636 3.052073 3.1711439 ] [ 9.10538 5.0676539 -11.1029745 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.086555409945372e-08 -1.012772155673926e-08 -4.553856873540732e-09 ] [ -2.761389400285226e-09 -1.979022196818189e-09 1.579373494838931e-09 ] [ -2.044990377764168e-09 3.655144089007191e-09 -3.877242620542172e-09 ] [ -1.062543308177912e-08 -4.557637049090992e-09 1.955991949119251e-08 ] [ 3.170893987959132e-08 4.889960045862281e-09 5.080732659631632e-09 ] [ 1.458842707969092e-08 8.119276667778971e-09 -1.778892631179783e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.3174520556426206 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.086142659658745e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.5970338 1.1340799 0.2417521 ] [ 0.686542 -0.4286025 2.0127805 ] [ 1.6662516 2.8470925 1.4396791 ] [ 0.5060041 2.1240511 3.1894656 ] [ 2.6710527 0.7249778 1.4488121 ] [ 2.6072028 2.0169869 -0.4583671 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.970338e-11 1.1340799e-10 2.417521e-11 ] [ 6.86542e-11 -4.286025e-11 2.0127805e-10 ] [ 1.6662516e-10 2.8470925e-10 1.4396791e-10 ] [ 5.060041e-11 2.1240511e-10 3.1894656e-10 ] [ 2.6710527e-10 7.249778e-11 1.4488121e-10 ] [ 2.6072028e-10 2.0169869e-10 -4.583671000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.13e-05 9.7e-06 0.0001989 ] [ 4.39e-05 3.02e-05 1.99e-05 ] [ 3.09e-05 -6.72e-05 0.0001575 ] [ -4.28e-05 2.34e-05 -0.0002659 ] [ -3.07e-05 -2.91e-05 -8.2e-05 ] [ -2.26e-05 3.29e-05 -2.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.41263623042e-14 1.55411133498e-14 3.186729325026e-13 ] [ 7.03355542326e-14 4.838573434679999e-14 3.18833150166e-14 ] [ 4.950725799059999e-14 -1.076662698048e-13 2.52342819855e-13 ] [ -6.857315993519999e-14 3.749093323559999e-14 -4.260187669806e-13 ] [ -4.91868226638e-14 -4.66233400494e-14 -1.31378483988e-13 ] [ -3.62091919284e-14 5.271161125859999e-14 -4.53415987422e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.450040055642619 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.475369317151466e-18 } }