{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5719038 -1.2483438 -2.5653083 ] [ -1.8878939 -0.4680662 1.4043496 ] [ -1.461759 1.6901368 1.2005781 ] [ -1.1310811 -2.5548022 1.248832 ] [ 6.0526378 2.5810754 -1.2884515 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.518467518506679e-09 -2.000067251080631e-09 -4.110076983404192e-09 ] [ -3.024739469130933e-09 -7.499247226266969e-10 2.250016096549832e-09 ] [ -2.341996095043987e-09 2.707897666913726e-09 1.923538163264484e-09 ] [ -1.812191694648747e-09 -4.093244355608406e-09 2.000849433706906e-09 ] [ 9.697394777330347e-09 4.135338662402008e-09 -2.064326870334691e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.513987 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.844744078359513e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1772077 2.9025338 0.9245692 ] [ 1.7321262 5.1215145 1.7983059 ] [ 2.2868522 4.3533757 4.0316074 ] [ 2.7319775 2.1344038 3.1578651 ] [ 3.9469934 4.0786582 2.2071104 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1772077e-10 2.9025338e-10 9.245692e-11 ] [ 1.7321262e-10 5.1215145e-10 1.7983059e-10 ] [ 2.2868522e-10 4.3533757e-10 4.031607400000001e-10 ] [ 2.7319775e-10 2.1344038e-10 3.1578651e-10 ] [ 3.9469934e-10 4.078658199999999e-10 2.2071104e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.19e-05 -1.31e-05 -3.7e-06 ] [ -1.1e-05 -1.08e-05 1.19e-05 ] [ 2.43e-05 2.7e-06 7e-07 ] [ -1.36e-05 3.84e-05 -2.35e-05 ] [ -2.15e-05 -1.73e-05 1.47e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.508766799552e-14 -2.098851373248e-14 -5.928053496960001e-15 ] [ -1.76239428288e-14 -1.730350750464e-14 1.906590178752e-14 ] [ 3.893289188544e-14 4.32587687616e-15 1.12152363456e-15 ] [ -2.178960204288e-14 6.152358223872e-14 -3.76511505888e-14 ] [ -3.44467973472e-14 -2.771765553984e-14 2.355199632576e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.867937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.221888444012729e-18 } }