{ "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" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0657952 -0.0477619 -0.196563 ] [ -0.9240792 -28.1947929 10.9024176 ] [ -6.8617672 21.3454224 -7.390692 ] [ -19.5756395 -47.9034988 -43.7688853 ] [ 22.8041268 32.3453105 41.8905739 ] [ 4.4915639 22.4553207 -1.4368513 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.054155312008602e-10 -7.652299954498752e-11 -3.149286431143104e-10 ] [ -1.480538090007567e-09 -4.517303801267784e-08 1.746759858891845e-08 ] [ -1.099376298521228e-08 3.419913673038063e-08 -1.184119393393359e-08 ] [ -3.1363631944109e-08 -7.674986583188086e-08 -7.01254847461368e-08 ] [ 3.653623881671872e-08 5.182290027561675e-08 6.711609813447467e-08 ] [ 7.19627867140927e-09 3.59773898381063e-08 -2.302089560426087e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.7984667 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.569887426642733e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0295228 0.6199691 0.5322315 ] [ 0.7094129 0.433181 3.0571586 ] [ 0.1089308 2.6807273 1.9805852 ] [ 2.2331455 -0.4652678 1.1223675 ] [ 3.145846 1.1851783 2.7938265 ] [ 2.3458434 3.3794873 2.3644295 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.95228e-12 6.199691e-11 5.322315e-11 ] [ 7.094129e-11 4.33181e-11 3.0571586e-10 ] [ 1.089308e-11 2.6807273e-10 1.9805852e-10 ] [ 2.2331455e-10 -4.652678e-11 1.1223675e-10 ] [ 3.145846e-10 1.1851783e-10 2.7938265e-10 ] [ 2.3458434e-10 3.3794873e-10 2.3644295e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.61e-05 -1.05e-05 9.7e-06 ] [ -1.13e-05 -7.7e-06 -8e-06 ] [ 6.2e-06 -5.8e-06 -2.22e-05 ] [ 5.5e-06 2.49e-05 8.4e-06 ] [ 2.09e-05 -1.67e-05 7e-07 ] [ 4.7e-06 1.58e-05 1.12e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.181680980288e-14 -1.68228545184e-14 1.554111322176e-14 ] [ -1.810459581504e-14 -1.233675998016e-14 -1.28174129664e-14 ] [ 9.93349504896e-15 -9.292624400640001e-15 -3.556832098176e-14 ] [ 8.8119714144e-15 3.989419785791999e-14 1.345828361472e-14 ] [ 3.348549137472e-14 -2.675634956736e-14 1.12152363456e-15 ] [ 7.53023011776e-15 2.531439060864e-14 1.794437815296e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.047461 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.250651359579979e-18 } }