{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.301375 1.527111 2.019819 ] [ 1.794175 5.106546 1.47688 ] [ 0.9503771 3.237781 1.232452 ] [ 3.392468 3.669062 0.7528338 ] [ 3.101246 3.595776 2.776891 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.301375e-10 1.527111e-10 2.019819e-10 ] [ 1.794175e-10 5.106546e-10 1.47688e-10 ] [ 9.503771e-11 3.237781e-10 1.232452e-10 ] [ 3.392468e-10 3.669062e-10 7.528338e-11 ] [ 3.101246e-10 3.595776e-10 2.776891e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1990234 -6.0567007 1.3691853 ] [ -0.3072951 20.757585 2.2618684 ] [ -14.0015343 -13.2247148 -4.5604048 ] [ 11.551045 -1.2056094 -23.9080041 ] [ 2.9568078 -0.2705601 24.8373551 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.188706384721268e-10 -9.703904260722996e-09 2.193676677203034e-09 ] [ -4.923410249063981e-10 3.325731739126877e-08 3.623912669806303e-09 ] [ -2.243293091078929e-08 -2.118832886930775e-08 -7.3065739519441e-09 ] [ 1.850681424480874e-08 -1.931599194496716e-09 -3.830484521901054e-08 ] [ 4.737328329359082e-09 -4.334850667413101e-10 3.979382966372765e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.0733147 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.719639719100966e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2379487 1.6146088 1.382441 ] [ 1.7062368 5.0526074 1.0522245 ] [ 0.259062 3.0698418 1.2294293 ] [ 3.6615809 3.5795248 1.0573373 ] [ 3.6748127 3.8196932 3.5374438 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2379487e-10 1.6146088e-10 1.382441e-10 ] [ 1.7062368e-10 5.052607400000001e-10 1.0522245e-10 ] [ 2.59062e-11 3.0698418e-10 1.2294293e-10 ] [ 3.6615809e-10 3.5795248e-10 1.0573373e-10 ] [ 3.6748127e-10 3.8196932e-10 3.5374438e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.12e-05 3.85e-05 -5.39e-05 ] [ 7.02e-05 -1.43e-05 -5.3e-06 ] [ -9.6e-06 -5.05e-05 4.17e-05 ] [ -2.06e-05 1.1e-06 6.05e-05 ] [ -1.87e-05 2.53e-05 -4.3e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.396614436096001e-14 6.16837999008e-14 -8.635731986112e-14 ] [ 1.1247279878016e-13 -2.291112567744e-14 -8.491536090240001e-15 ] [ -1.538089555968e-14 -8.090991935040001e-14 6.681076508736e-14 ] [ -3.300483838848e-14 1.76239428288e-15 9.69316855584e-14 ] [ -2.996070280896e-14 4.053506850624e-14 -6.889359469439999e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.027456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927010881090069e-18 } }