{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.825241 1.571351 1.750599 ] [ 0.5622357 3.903382 1.066374 ] [ 3.055372 3.197946 1.429481 ] [ 3.763641 1.041333 1.110804 ] [ 3.309317 1.461591 3.355414 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.825241e-10 1.571351e-10 1.750599e-10 ] [ 5.622357e-11 3.903382e-10 1.066374e-10 ] [ 3.055372e-10 3.197946e-10 1.429481e-10 ] [ 3.763641e-10 1.041333e-10 1.110804e-10 ] [ 3.309317e-10 1.461591e-10 3.355414e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -33.5723141 16.6202209 -7.7580905 ] [ 14.3140431 -20.2718213 6.1816651 ] [ -3.8080916 24.1710341 -5.6996827 ] [ 18.4531203 -17.5751727 -19.7072096 ] [ 4.6132422 -2.944261 26.9833176 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.378877720032873e-08 2.662852957789845e-08 -1.242983132355737e-08 ] [ 2.293362539288892e-08 -3.24790384154835e-08 9.904119382433272e-09 ] [ -6.101235381651673e-09 3.872626605463722e-08 -9.131898443154032e-09 ] [ 2.956515816905107e-08 -2.815853103845469e-08 -3.157443074246048e-08 ] [ 7.391228859822754e-09 -4.717226178597474e-09 4.323204096652095e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2254585 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.769930876636689e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.4177901 1.4378393 1.7434494 ] [ 0.8332168 3.6805276 1.0809421 ] [ 3.1741124 3.3911177 1.5776579 ] [ 3.7706956 1.0249682 0.9128291 ] [ 3.3199918 1.6411502 3.3977935 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4177901e-10 1.4378393e-10 1.7434494e-10 ] [ 8.332168e-11 3.6805276e-10 1.0809421e-10 ] [ 3.1741124e-10 3.3911177e-10 1.5776579e-10 ] [ 3.7706956e-10 1.0249682e-10 9.128291e-11 ] [ 3.3199918e-10 1.6411502e-10 3.3977935e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.75e-05 2.8e-05 -2.29e-05 ] [ -2.29e-05 4e-06 6.8e-05 ] [ 1.44e-05 -9.3e-05 -1.31e-05 ] [ 2.69e-05 9.1e-06 4.78e-05 ] [ -5.59e-05 5.18e-05 -7.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.008162377499999e-14 4.486094575199999e-14 -3.66898449186e-14 ] [ -3.66898449186e-14 6.408706535999999e-15 1.08948011112e-13 ] [ 2.30713435296e-14 -1.49002426962e-13 -2.09885139054e-14 ] [ 4.309855145459999e-14 1.45798073694e-14 7.65840431052e-14 ] [ -8.956167384059998e-14 8.299274964119999e-14 -1.278536953932e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.808941 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.693089251248459e-18 } }