{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4958536 -1.5914602 -1.7004033 ] [ 0.778597 -1.5044093 -0.3438309 ] [ -1.0629915 1.2750288 0.6897543 ] [ 0.5391769 1.35753 -1.5681801 ] [ -0.6373546 0.4540801 1.3493772 ] [ 0.694159 -1.1674665 1.2446204 ] [ 1.1842668 1.1766972 0.3286625 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.396621666059515e-09 -2.549800325373693e-09 -2.724346413191169e-09 ] [ 1.247449910425018e-09 -2.410329408574094e-09 -5.508778294886227e-10 ] [ -1.703100129409123e-09 2.042821334206679e-09 1.105108213556269e-09 ] [ 8.638566236554195e-10 2.175002828034624e-09 -2.512501493423806e-09 ] [ -1.021154639279336e-09 7.275165201905261e-10 2.161940602480566e-09 ] [ 1.112165320917907e-09 -1.870487531867203e-09 1.994101706650744e-09 ] [ 1.89740457974963e-09 1.885276743600822e-09 5.265753736336801e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -30.455518 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.879511891395358e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4335912 1.7132262 3.5728521 ] [ 2.8647226 3.5261941 1.9575184 ] [ 5.3275494 0.6241421 1.8619332 ] [ 5.265987 2.9514839 1.8914788 ] [ 3.1806907 1.3847101 1.150824 ] [ 4.9174781 1.3933864 4.0830153 ] [ 4.0526649 3.5321327 3.9630514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4335912e-10 1.7132262e-10 3.5728521e-10 ] [ 2.8647226e-10 3.5261941e-10 1.9575184e-10 ] [ 5.3275494e-10 6.241421000000001e-11 1.8619332e-10 ] [ 5.265987e-10 2.9514839e-10 1.8914788e-10 ] [ 3.1806907e-10 1.3847101e-10 1.150824e-10 ] [ 4.9174781e-10 1.3933864e-10 4.0830153e-10 ] [ 4.0526649e-10 3.5321327e-10 3.9630514e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.61e-05 7.9e-06 1.22e-05 ] [ 3.41e-05 -3.85e-05 -2.08e-05 ] [ 1.11e-05 1.54e-05 -4.6e-05 ] [ 4.5e-06 2.76e-05 2.62e-05 ] [ -3.44e-05 7e-07 1.33e-05 ] [ -1.54e-05 1.79e-05 3.89e-05 ] [ 1.63e-05 -3.1e-05 -2.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.579504359488e-14 1.265719530432e-14 1.954655477376e-14 ] [ 5.463422276928e-14 -6.16837999008e-14 -3.332527371264e-14 ] [ 1.778416049088e-14 2.467351996032e-14 -7.37001245568e-14 ] [ 7.2097947936e-15 4.422007473408001e-14 4.197702746496e-14 ] [ -5.511487575552001e-14 1.12152363456e-15 2.130894905664e-14 ] [ -2.467351996032e-14 2.867896151232001e-14 6.232467054911999e-14 ] [ 2.611547891904e-14 -4.96674752448e-14 -3.813180357504e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.196266 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.158410466225794e-18 } }