{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6044136 -0.943672 -1.555592 ] [ -3.0386025 -0.8549098 8.0733204 ] [ -3.902204 1.9080402 -1.6472014 ] [ -0.6166513 -9.8386849 -1.3195953 ] [ 2.8312255 0.7503801 -6.4567595 ] [ -1.2507019 7.8929394 -0.6472356 ] [ 8.5813477 1.0859069 3.5530634 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.172730580813563e-09 -1.511929216103578e-09 -2.492333133903514e-09 ] [ -4.868377885404432e-09 -1.369716494452804e-09 1.29348851971077e-08 ] [ -6.252020018392243e-09 3.057017399986556e-09 -2.639107572829029e-09 ] [ -9.87984296045927e-10 -1.576331092619799e-08 -2.114224738577563e-09 ] [ 4.53612330431279e-09 1.202241452933566e-09 -1.03448691170283e-08 ] [ -2.00384534377014e-09 1.264588297607118e-08 -1.03698574646946e-09 ] [ 1.374883465989585e-08 1.739814647545403e-09 5.692635111700159e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5155206 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.524554464006079e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0854497 2.3906968 1.7561799 ] [ 2.4608428 2.765366 4.9843011 ] [ 1.3478964 3.8871436 3.3366606 ] [ 3.2275527 1.2097316 3.3413232 ] [ 4.0107624 3.5814343 1.4610868 ] [ 3.2440176 5.1370889 3.1040335 ] [ 4.6243104 3.2049449 3.8408319 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0854497e-10 2.3906968e-10 1.7561799e-10 ] [ 2.4608428e-10 2.765366e-10 4.9843011e-10 ] [ 1.3478964e-10 3.8871436e-10 3.3366606e-10 ] [ 3.2275527e-10 1.2097316e-10 3.3413232e-10 ] [ 4.0107624e-10 3.5814343e-10 1.4610868e-10 ] [ 3.2440176e-10 5.1370889e-10 3.1040335e-10 ] [ 4.6243104e-10 3.2049449e-10 3.8408319e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-06 -1.98e-05 -8e-07 ] [ 1.68e-05 1.15e-05 -1.99e-05 ] [ -8.7e-06 2.56e-05 -1.5e-05 ] [ 1.5e-05 -1.52e-05 1e-06 ] [ -1.32e-05 5.2e-06 1.01e-05 ] [ -1.4e-06 3.5e-06 1.71e-05 ] [ -1.5e-06 -1.08e-05 7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-14 -3.172309709184e-14 -1.28174129664e-15 ] [ 2.691656722944e-14 1.84250311392e-14 -3.188331475392e-14 ] [ -1.393893660096e-14 4.101572149248001e-14 -2.4032649312e-14 ] [ 2.4032649312e-14 -2.435308463616e-14 1.6021766208e-15 ] [ -2.114873139456e-14 8.33131842816e-15 1.618198387008e-14 ] [ -2.24304726912e-15 5.6076181728e-15 2.739722021568e-14 ] [ -2.4032649312e-15 -1.730350750464e-14 1.2016324656e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }