{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.443821e-11 -6.01967e-12 1.3626251e-10 ] [ 2.1995082e-10 1.1873848e-10 6.425548e-10 ] [ -9.724701e-11 4.7986976e-10 3.5152147e-10 ] [ 5.0280141e-10 2.8472723e-10 4.755150000000001e-11 ] [ 3.9357544e-10 7.276160400000001e-10 3.6616822e-10 ] [ 7.2101973e-10 3.2617447e-10 5.508964e-10 ] ] "source-value" [ [ 0.4443821 -0.0601967 1.3626251 ] [ 2.1995082 1.1873848 6.425548 ] [ -0.9724701 4.7986976 3.5152147 ] [ 5.0280141 2.8472723 0.475515 ] [ 3.9357544 7.2761604 3.6616822 ] [ 7.2101973 3.2617447 5.508964 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.6021766208e-16 -4.8065298624e-16 -1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ -8.010883104e-16 0.0 1.6021766208e-16 ] [ 0.0 0.0 0.0 ] [ 3.2043532416e-16 8.010883104e-16 -1.6021766208e-16 ] [ 3.2043532416e-16 -4.8065298624e-16 1.6021766208e-16 ] ] "source-value" [ [ 1e-07 -3e-07 -1e-07 ] [ 0.0 0.0 0.0 ] [ -5e-07 0.0 1e-07 ] [ 0.0 0.0 0.0 ] [ 2e-07 5e-07 -1e-07 ] [ 2e-07 -3e-07 1e-07 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 3.803373274190422e-31 "source-value" 2.3738789e-12 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.056244670202345e-09 -4.103011704941789e-09 -3.132121511916163e-09 ] [ -5.910617008795834e-10 -3.072861324589647e-09 4.972662600346331e-09 ] [ -4.749559025246945e-09 2.710683371404311e-09 1.097000719202035e-10 ] [ 2.936940510746417e-09 -1.031930719013174e-09 -5.052421996665335e-09 ] [ 5.494036667798246e-10 5.558844551891944e-09 3.11214797707296e-10 ] [ 4.910521218802631e-09 -6.172401453398207e-11 2.790966038607667e-09 ] ] "source-value" [ [ -1.9075579 -2.5608985 -1.9549165 ] [ -0.3689117 -1.9179292 3.1036919 ] [ -2.9644416 1.6918755 0.0684694 ] [ 1.8330941 -0.6440805 -3.1534738 ] [ 0.3429108 3.4695579 0.194245 ] [ 3.0649063 -0.0385251 1.741984 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 2.190593608731629e-18 "source-value" 13.67261 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.797173e-10 1.880519e-10 2.621604e-10 ] [ 2.732492e-10 2.231734e-10 4.550403000000001e-10 ] [ 1.229923e-10 3.945183e-10 3.396256e-10 ] [ 3.798537e-10 2.960677e-10 2.455754e-10 ] [ 3.373455e-10 4.934702e-10 3.584472e-10 ] [ 4.913806e-10 3.358248e-10 4.34106e-10 ] ] "source-value" [ [ 1.797173 1.880519 2.621604 ] [ 2.732492 2.231734 4.550403 ] [ 1.229923 3.945183 3.396256 ] [ 3.798537 2.960677 2.455754 ] [ 3.373455 4.934702 3.584472 ] [ 4.913806 3.358248 4.34106 ] ] } "instance-id" 1 }