{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.044824 1.955008 1.363184 ] [ 4.804837 1.704442 0.3842414 ] [ 5.395877 3.200403 2.033527 ] [ 3.92549 3.943599 0.3069547 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.044824e-10 1.955008e-10 1.363184e-10 ] [ 4.804837e-10 1.704442e-10 3.842414e-11 ] [ 5.395877e-10 3.200403e-10 2.033527e-10 ] [ 3.92549e-10 3.943599e-10 3.069547e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3017063 3.2405186 4.1453208 ] [ 6.1011865 -0.5119389 -4.1761646 ] [ -3.106845 -1.0084351 -0.7189059 ] [ 0.3073647 -1.7201446 0.7497497 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.289916686190594e-09 5.191883182962392e-09 6.641536126194186e-09 ] [ 9.77517844997624e-09 -8.202165436156625e-10 -6.690953341857956e-09 ] [ -4.977714464459729e-09 -1.615691154125453e-09 -1.15181423502474e-09 ] [ 4.924525404564198e-10 -2.755975485221276e-09 1.20123145068851e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.943584 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.234008447901625e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.117354 2.1275699 1.567456 ] [ 4.9442402 1.7492318 0.1987194 ] [ 5.1604389 3.0891043 2.0727777 ] [ 3.948995 3.8375461 0.248954 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.117354e-10 2.1275699e-10 1.567456e-10 ] [ 4.944240200000001e-10 1.7492318e-10 1.987194e-11 ] [ 5.1604389e-10 3.0891043e-10 2.0727777e-10 ] [ 3.948995e-10 3.8375461e-10 2.48954e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.3e-06 3e-06 -7e-07 ] [ -1.5e-06 5.3e-06 5.6e-06 ] [ -8e-06 -3.6e-06 -1.01e-05 ] [ 3.2e-06 -4.6e-06 5.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.00937127942e-14 4.806529901999999e-15 -1.1215236438e-15 ] [ -2.403264951e-15 8.4915361602e-15 8.972189150399999e-15 ] [ -1.2817413072e-14 -5.767835882399999e-15 -1.61819840034e-14 ] [ 5.1269652288e-15 -7.370012516399999e-15 8.331318496799998e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.70586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.516356190887524e-18 } }