{ "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" [ [ 1.825241 1.571351 1.750599 ] [ 0.5622357 3.903382 1.066374 ] [ 3.055372 3.197946 1.429481 ] [ 3.763641 1.041333 1.110804 ] [ 3.309317 1.461591 3.355414 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.825241e-10 1.571351e-10 1.750599e-10 ] [ 5.622357e-11 3.903382e-10 1.066374e-10 ] [ 3.055372e-10 3.197946e-10 1.429481e-10 ] [ 3.763641e-10 1.041333e-10 1.110804e-10 ] [ 3.309317e-10 1.461591e-10 3.355414e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -272.7960305 77.8803148 -39.0477847 ] [ -85.1780023 -111.4061855 21.2621969 ] [ 235.5882755 110.8172775 -5.6931765 ] [ 93.902378 -67.4570712 -72.0302803 ] [ 28.4833793 -9.8343356 95.5090446 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.370674223141437e-07 1.247780195931042e-07 -6.256144774037195e-08 ] [ -1.364702038915086e-07 -1.78492385820608e-07 3.406579478002624e-08 ] [ 3.774540271406895e-07 1.775488511912059e-07 -9.12147428638797e-09 ] [ 1.504481946691243e-07 -1.08078142384281e-07 -1.154052310863308e-07 ] [ 4.563540439583867e-08 -1.575634257942114e-08 1.530223583330645e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 89.616581 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.435815909142295e-17 } "relaxed-configuration-positions" { "source-value" [ [ 1.0426352 0.8365895 1.854595 ] [ 0.9027492 3.6169698 1.1085373 ] [ 3.7443978 3.8229932 1.5435999 ] [ 3.6807429 1.0451494 0.545759 ] [ 3.1452816 1.8539011 3.6601808 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0426352e-10 8.365895e-11 1.854595e-10 ] [ 9.027492000000001e-11 3.6169698e-10 1.1085373e-10 ] [ 3.744397800000001e-10 3.8229932e-10 1.5435999e-10 ] [ 3.6807429e-10 1.0451494e-10 5.45759e-11 ] [ 3.1452816e-10 1.8539011e-10 3.6601808e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.17e-05 5.9e-06 7.8e-06 ] [ 1.53e-05 -2e-07 3.5e-06 ] [ -1.57e-05 6e-07 4.4e-06 ] [ -9e-07 -7e-06 -4.4e-06 ] [ -1.04e-05 8e-07 -1.13e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.874546646336e-14 9.45284206272e-15 1.249697764224e-14 ] [ 2.451330229824e-14 -3.2043532416e-16 5.6076181728e-15 ] [ -2.515417294656e-14 9.6130597248e-16 7.04957713152e-15 ] [ -1.44195895872e-15 -1.12152363456e-14 -7.04957713152e-15 ] [ -1.666263685632e-14 1.28174129664e-15 -1.810459581504e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.133456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.943993953270549e-18 } }