{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6824875 -2.1652103 -4.4791973 ] [ 1.6131554 -8.4761789 -1.6703403 ] [ -3.8102485 1.209133 -11.9808343 ] [ -2.0359555 -8.0008003 9.3024564 ] [ 12.492036 3.5707906 1.693095 ] [ 3.8309764 9.3810014 -4.8364971 ] [ -1.4074763 4.4812645 11.9713175 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.711523172448824e-08 -3.469049321775354e-09 -7.176465194010484e-09 ] [ 2.584559867597272e-09 -1.358033566729826e-08 -2.676180177440058e-09 ] [ -6.10469106613827e-09 1.937244624037766e-09 -1.919541261313874e-08 ] [ -3.261960303089175e-09 -1.281869518834963e-08 1.490417816009133e-08 ] [ 2.001444802539195e-08 5.721037217092404e-09 2.712637225793376e-09 ] [ 6.13790082291655e-09 1.503002112277207e-08 -7.748922580187e-09 ] [ -2.255025622190087e-09 7.179777213521001e-09 1.91801650186739e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -8.4924742 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.360644361598718e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5688056 2.8535422 2.4943034 ] [ 4.7791094 1.4179553 2.1633303 ] [ 3.3948188 3.0218228 0.9406409 ] [ 3.2926244 1.6425736 4.0299082 ] [ 6.3372991 3.1911402 2.5763711 ] [ 4.542215 4.743796 2.2452125 ] [ 3.1090707 4.2197787 4.093373 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5688056e-10 2.8535422e-10 2.4943034e-10 ] [ 4.7791094e-10 1.4179553e-10 2.1633303e-10 ] [ 3.3948188e-10 3.0218228e-10 9.406409e-11 ] [ 3.2926244e-10 1.6425736e-10 4.029908200000001e-10 ] [ 6.337299100000001e-10 3.1911402e-10 2.5763711e-10 ] [ 4.542215e-10 4.743795999999999e-10 2.2452125e-10 ] [ 3.1090707e-10 4.2197787e-10 4.093373e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 -1.33e-05 -6e-06 ] [ 8e-06 3.7e-05 2.8e-06 ] [ -1.31e-05 2.64e-05 -6.8e-06 ] [ -1.9e-06 -5.25e-05 3.52e-05 ] [ 3.4e-06 -1.29e-05 -7e-06 ] [ 2.56e-05 -1.63e-05 -9.7e-06 ] [ -1.68e-05 3.17e-05 -8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.17110076608e-15 -2.130894905664e-14 -9.6130597248e-15 ] [ 1.28174129664e-14 5.92805349696e-14 4.48609453824e-15 ] [ -2.098851373248e-14 4.229746278912e-14 -1.089480102144e-14 ] [ -3.04413557952e-15 -8.4114272592e-14 5.639661705216e-14 ] [ 5.44740051072e-15 -2.066807840832e-14 -1.12152363456e-14 ] [ 4.101572149248001e-14 -2.611547891904e-14 -1.554111322176e-14 ] [ -2.691656722944e-14 5.078899887936e-14 -1.345828361472e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }