{ "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" [ [ 2.420109 0.1444118 2.696301 ] [ 1.741529 2.490211 2.002098 ] [ 2.88298 4.123868 0.919121 ] [ 3.624829 1.629307 1.356835 ] [ 3.547112 2.169997 3.636924 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.420109e-10 1.444118e-11 2.696301e-10 ] [ 1.741529e-10 2.490211e-10 2.002098e-10 ] [ 2.88298e-10 4.123868e-10 9.19121e-11 ] [ 3.624829e-10 1.629307e-10 1.356835e-10 ] [ 3.547112e-10 2.169997e-10 3.636924e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.8921188 3.1569263 -3.1414356 ] [ 0.2474709 5.1922044 -1.9410728 ] [ -2.8621132 -3.2943386 2.4417263 ] [ -0.5775585 -4.0398313 7.0387747 ] [ 0.300082 -1.0149608 -4.3979926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.633685125936151e-09 5.057953511448647e-09 -5.03313467406882e-09 ] [ 3.964920903083347e-10 8.31882850009489e-09 -3.109941459430794e-09 ] [ -4.585610855123074e-09 -5.278112285919003e-09 3.912076792252487e-09 ] [ -9.253507258443168e-10 -6.472523260836072e-09 1.127736026341853e-08 ] [ 4.807843647229056e-10 -1.626146464788465e-09 -7.046360922171407e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4342568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.706639196383422e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2752588 -0.5370799 1.7945135 ] [ 1.422754 2.7552607 1.9890388 ] [ 2.8255369 4.0933287 0.9553157 ] [ 3.3775195 1.2428103 2.4718956 ] [ 4.3154898 3.0034751 3.4005153 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2752588e-10 -5.370799000000001e-11 1.7945135e-10 ] [ 1.422754e-10 2.7552607e-10 1.9890388e-10 ] [ 2.8255369e-10 4.0933287e-10 9.553157000000001e-11 ] [ 3.3775195e-10 1.2428103e-10 2.4718956e-10 ] [ 4.3154898e-10 3.0034751e-10 3.4005153e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.001516 -0.0035971 -0.0025765 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] [ 0.0024482 0.0066975 0.0054324 ] [ -0.0009323 -0.0031004 -0.0028559 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4288997571328e-12 -5.76318952267968e-12 -4.128008063491199e-12 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 3.92244880304256e-12 1.0730577917808e-11 8.703664274833922e-12 ] [ -1.49370926357184e-12 -4.96738839512832e-12 -4.575656211342721e-12 ] ] } "relaxed-potential-energy" { "source-value" -8.5392149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.368133047276701e-18 } }