{ "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" [ [ 2.317023 1.146232 2.35214 ] [ 1.137751 1.512768 4.697187 ] [ 2.525224 3.828296 5.439775 ] [ 1.195151 3.273987 3.261847 ] [ 3.958209 2.788765 2.245111 ] [ 4.201729 2.884975 4.427405 ] [ 3.756146 4.818354 3.421856 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.317023e-10 1.146232e-10 2.35214e-10 ] [ 1.137751e-10 1.512768e-10 4.697187e-10 ] [ 2.525224e-10 3.828296e-10 5.439775e-10 ] [ 1.195151e-10 3.273987e-10 3.261847e-10 ] [ 3.958209e-10 2.788765e-10 2.245111e-10 ] [ 4.201729000000001e-10 2.884975e-10 4.427405e-10 ] [ 3.756146e-10 4.818354e-10 3.421856e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8176375 -0.7798653 0.1908582 ] [ 1.9268286 1.1966448 1.7089555 ] [ -5.7641958 -2.7059509 1.7147813 ] [ 9.5081109 4.177257 -1.5363799 ] [ -3.6881022 -2.7365242 -4.7576204 ] [ 3.9122726 -5.5915394 5.2508447 ] [ -5.0772766 6.439978 -2.5714395 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.309999697582175e-09 -1.2494819613274e-09 3.057885484472987e-10 ] [ 3.087119760642932e-09 1.917236337757603e-09 2.738048570645787e-09 ] [ -9.235259824560938e-09 -4.33541130473127e-09 2.747382531280144e-09 ] [ 1.523367311746071e-08 6.692703559612938e-09 -2.461551976727257e-09 ] [ -5.908991168643994e-09 -4.384395131615542e-09 -7.622548238321734e-09 ] [ 6.268151745558429e-09 -8.95863377477038e-09 8.412780687102739e-09 ] [ -8.134693932874965e-09 1.031798227507405e-08 -4.119900282644642e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.800951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.852026775517893e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0746181 1.0198882 2.4851992 ] [ 1.0805923 1.5852734 4.6767279 ] [ 2.4273806 3.5271957 5.3407724 ] [ 1.4894158 3.5256241 2.9674247 ] [ 3.8166868 2.7369889 2.2786251 ] [ 4.734478 2.9291306 4.5936508 ] [ 3.4680614 4.9292761 3.5029208 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0746181e-10 1.0198882e-10 2.4851992e-10 ] [ 1.0805923e-10 1.5852734e-10 4.6767279e-10 ] [ 2.4273806e-10 3.5271957e-10 5.3407724e-10 ] [ 1.4894158e-10 3.5256241e-10 2.9674247e-10 ] [ 3.8166868e-10 2.7369889e-10 2.2786251e-10 ] [ 4.734478000000001e-10 2.9291306e-10 4.5936508e-10 ] [ 3.4680614e-10 4.9292761e-10 3.5029208e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.23e-05 -1.64e-05 8.63e-05 ] [ -2.56e-05 8.43e-05 -4.16e-05 ] [ -3.96e-05 -7.72e-05 -3.94e-05 ] [ 7.3e-06 -2.3e-05 5.81e-05 ] [ 4e-06 8.68e-05 3.52e-05 ] [ -3.15e-05 2.5e-06 -9.21e-05 ] [ 3.32e-05 -5.7e-05 -6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.379383795819998e-14 -2.62756967976e-14 1.382678435142e-13 ] [ -4.10157218304e-14 1.350634902462e-13 -6.665054797439999e-14 ] [ -6.34461947064e-14 -1.236880361448e-13 -6.31257593796e-14 ] [ 1.16958894282e-14 -3.6850062582e-14 9.308646243539999e-14 ] [ 6.408706535999999e-15 1.390689318312e-13 5.63966175168e-14 ] [ -5.046856397099999e-14 4.005441585e-15 -1.475604679914e-13 ] [ 5.31922642488e-14 -9.132406813799999e-14 -1.0414148121e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.198393 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.877009984494916e-18 } }