{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.2217443 -1.5425778 -0.3931971 ] [ 2.2265642 0.1186824 -0.0532118 ] [ 13.7427232 1.2076833 -8.9772883 ] [ 8.5585375 -13.0548424 -6.103248 ] [ -8.1414037 -10.8690321 6.9154088 ] [ -6.1017258 11.463802 0.1592794 ] [ -0.0629512 12.6762847 8.452257 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.637703974125566e-08 -2.471482086925099e-09 -6.299712009863598e-10 ] [ 3.567349105950255e-09 1.901501665804339e-10 -8.525470191068543e-11 ] [ 2.201826981716576e-08 1.934921948590593e-09 -1.438320143244138e-08 ] [ 1.371228869074008e-08 -2.091616328150856e-08 -9.778481256544359e-09 ] [ -1.304396666863462e-08 -1.741410912134473e-08 1.107970630263458e-08 ] [ -9.776042423292176e-09 1.836703554988028e-08 2.551937308550515e-10 ] [ -1.00858940891305e-10 2.030964698494474e-08 1.354200855839315e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -16.298688 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.611337686331351e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3098802 3.5684419 1.513825 ] [ 0.5765988 2.0030015 1.7142776 ] [ 2.7411614 4.5199213 3.7596203 ] [ 4.4242987 2.4513678 2.1589832 ] [ 3.3604359 2.1694255 4.4265602 ] [ 4.4171687 4.9749559 1.9120826 ] [ 5.1869775 3.938539 4.0609252 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3098802e-10 3.5684419e-10 1.513825e-10 ] [ 5.765988e-11 2.0030015e-10 1.7142776e-10 ] [ 2.741161400000001e-10 4.5199213e-10 3.7596203e-10 ] [ 4.4242987e-10 2.4513678e-10 2.1589832e-10 ] [ 3.3604359e-10 2.1694255e-10 4.4265602e-10 ] [ 4.417168700000001e-10 4.974955900000001e-10 1.9120826e-10 ] [ 5.186977500000001e-10 3.938539e-10 4.0609252e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0002366 2.57e-05 -0.0001488 ] [ 5.19e-05 -3.61e-05 0.0001019 ] [ -4.28e-05 -8.12e-05 0.000116 ] [ -8.8e-06 -0.0001622 0.0001043 ] [ 2.09e-05 6e-05 -0.0001948 ] [ 0.0002021 0.0002041 -0.000173 ] [ 1.34e-05 -1.03e-05 0.0001944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.7907498848128e-13 4.117593915456e-14 -2.3840388117504e-13 ] [ 8.315296661952001e-14 -5.783857601088001e-14 1.6326179765952e-13 ] [ -6.857315937023999e-14 -1.3009674160896e-13 1.858524880128e-13 ] [ -1.409915426304e-14 -2.5987304789376e-13 1.6710702154944e-13 ] [ 3.348549137472e-14 9.6130597248e-14 -3.1210400573184e-13 ] [ 3.2379989506368e-13 3.2700424830528e-13 -2.771765553984e-13 ] [ 2.146916671872e-14 -1.650241919424e-14 3.1146313508352e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.571057 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.936717307374419e-18 } }