{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1846173 -3.9326482 1.3663451 ] [ -1.578542 2.5821731 -2.9558826 ] [ 7.9016369 -3.4213251 0.7060076 ] [ 4.5817444 8.3738267 -0.9176155 ] [ -7.7009912 -0.6909763 -8.2606568 ] [ -4.2555364 -5.0563735 6.1588566 ] [ 3.2363056 2.1453234 3.9029456 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.500142792292168e-09 -6.300797055782157e-09 2.189126193200393e-09 ] [ -2.529103108187628e-09 4.137097405763344e-09 -4.735846034567167e-09 ] [ 1.265981801153219e-08 -5.481567132537713e-09 1.131148880146418e-09 ] [ 7.340763820640348e-09 1.341634947590533e-08 -1.470182113096227e-09 ] [ -1.233834815927962e-08 -1.107066082507774e-09 -1.323503130645321e-08 ] [ -6.818120985216477e-09 -8.101203474476799e-09 9.867576136676684e-09 ] [ 5.185133212803351e-09 3.437187023853436e-09 6.25320824409311e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.4850495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.519672468123338e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2114914 2.3875743 4.6628706 ] [ 2.4521192 3.4339893 2.4358375 ] [ 5.389959 1.2924381 3.1193737 ] [ 4.8115349 3.5857468 3.0114849 ] [ 2.3442433 1.163215 1.3143233 ] [ 3.2343663 0.4459458 3.6116589 ] [ 4.2450139 3.6393176 5.513629 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2114914e-10 2.3875743e-10 4.6628706e-10 ] [ 2.4521192e-10 3.4339893e-10 2.4358375e-10 ] [ 5.389959e-10 1.2924381e-10 3.1193737e-10 ] [ 4.8115349e-10 3.5857468e-10 3.0114849e-10 ] [ 2.3442433e-10 1.163215e-10 1.3143233e-10 ] [ 3.2343663e-10 4.459458e-11 3.6116589e-10 ] [ 4.2450139e-10 3.6393176e-10 5.513629e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.03e-05 5.2e-06 -6.4e-06 ] [ -2.2e-06 2.17e-05 5.3e-06 ] [ -5.4e-06 2e-06 -1.24e-05 ] [ -4e-06 -1.06e-05 1.16e-05 ] [ 1.02e-05 -1.4e-05 9.5e-06 ] [ -3.2e-06 -1.19e-05 -6.4e-06 ] [ -5.7e-06 7.6e-06 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.65024193302e-14 8.331318496799998e-15 -1.02539304576e-14 ] [ -3.5247885948e-15 3.476723295779999e-14 8.4915361602e-15 ] [ -8.6517538236e-15 3.204353268e-15 -1.98669902616e-14 ] [ -6.408706535999999e-15 -1.69830723204e-14 1.85852489544e-14 ] [ 1.63422016668e-14 -2.243047287599999e-14 1.5220678023e-14 ] [ -5.1269652288e-15 -1.90659019446e-14 -1.02539304576e-14 ] [ -9.1324068138e-15 1.21765424184e-14 -1.9226119608e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.978138 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.040632926042749e-18 } }