{ "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" [ [ 2.941384 3.398999 4.495714 ] [ 5.079285 2.89491 3.814281 ] [ 5.144035 3.811985 1.647129 ] [ 3.115427 4.213177 2.153983 ] [ 4.243195 5.045313 3.693161 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.941384e-10 3.398999e-10 4.495714000000001e-10 ] [ 5.079285e-10 2.89491e-10 3.814281e-10 ] [ 5.144035e-10 3.811985e-10 1.647129e-10 ] [ 3.115427e-10 4.213177e-10 2.153983e-10 ] [ 4.243195e-10 5.045313e-10 3.693161e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.1516839 -8.2938224 13.8252794 ] [ 21.8203306 -21.1065588 13.2633028 ] [ 11.9051399 -5.1112868 -17.041488 ] [ -23.9160197 7.6237483 -23.7645592 ] [ 3.3422331 26.8879198 13.717465 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.107132046873176e-08 -1.328816834634735e-08 2.215053943070785e-08 ] [ 3.496002354544683e-08 -3.38164350549005e-08 2.125015366075118e-08 ] [ 1.907413681513325e-08 -8.189184213163645e-09 -2.730347365724375e-08 ] [ -3.831768762593223e-08 1.221459128912374e-08 -3.807502115385755e-08 ] [ 5.354847734083909e-09 4.307919648550542e-08 2.197780171964228e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 14.061292 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.252867330064208e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.8269674 3.5546348 5.1165345 ] [ 5.0964932 2.2095498 3.6635498 ] [ 4.995197 3.1630264 1.5158162 ] [ 3.6631222 5.0974275 1.6414469 ] [ 2.9415461 5.3397455 3.8669205 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.8269674e-10 3.5546348e-10 5.1165345e-10 ] [ 5.096493200000001e-10 2.2095498e-10 3.6635498e-10 ] [ 4.995197000000001e-10 3.1630264e-10 1.5158162e-10 ] [ 3.6631222e-10 5.097427500000001e-10 1.6414469e-10 ] [ 2.9415461e-10 5.339745500000001e-10 3.8669205e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.32e-05 3.35e-05 2.76e-05 ] [ 1.6e-06 -1.4e-05 -4.44e-05 ] [ 9e-06 -3.89e-05 2.06e-05 ] [ 1.16e-05 4.07e-05 -2.7e-06 ] [ -3.54e-05 -2.13e-05 -1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.114873139456e-14 5.36729167968e-14 4.422007473408001e-14 ] [ 2.56348259328e-15 -2.24304726912e-14 -7.113664196352e-14 ] [ 1.44195895872e-14 -6.232467054911999e-14 3.300483838848e-14 ] [ 1.858524880128e-14 6.520858846656e-14 -4.32587687616e-15 ] [ -5.671705237632e-14 -3.412636202304e-14 -1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }