{ "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" [ [ 0.9320143 3.012582 2.150962 ] [ 2.172573 2.316103 4.293659 ] [ 2.198257 4.51425 3.345177 ] [ 3.106694 2.5483 1.973249 ] [ 3.92193 5.175884 1.747773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.320143e-11 3.012582e-10 2.150962e-10 ] [ 2.172573e-10 2.316103e-10 4.293659e-10 ] [ 2.198257e-10 4.51425e-10 3.345177e-10 ] [ 3.106694e-10 2.5483e-10 1.973249e-10 ] [ 3.92193e-10 5.175884e-10 1.747773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.5403253 -0.2319923 -0.1225707 ] [ 0.0648457 -0.0454427 -0.4771633 ] [ 1.2978064 1.3195847 -0.4331555 ] [ 1.8357668 1.2685412 -0.1021381 ] [ -1.6580936 -2.3106909 1.1350276 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.467873184086746e-09 -3.716926392656199e-10 -1.963799099350906e-10 ] [ 1.038942644994106e-10 -7.280723152602817e-11 -7.644998835637766e-10 ] [ 2.079315072404613e-09 2.114207755505382e-09 -6.939916152709345e-10 ] [ 2.94122264820083e-09 2.032427053161577e-09 -1.636432759129325e-10 ] [ -2.656558801018107e-09 -3.70213493787531e-09 1.818514684682734e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.188597 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.433481501615302e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.230202 3.3450771 1.9969932 ] [ 2.2637552 2.4443087 4.0404489 ] [ 2.091998 4.8095567 3.7768611 ] [ 3.458635 2.3014649 1.9800513 ] [ 3.2868782 4.6667117 1.7164655 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.230202e-10 3.345077100000001e-10 1.9969932e-10 ] [ 2.2637552e-10 2.4443087e-10 4.040448900000001e-10 ] [ 2.091998e-10 4.8095567e-10 3.7768611e-10 ] [ 3.458635e-10 2.3014649e-10 1.9800513e-10 ] [ 3.2868782e-10 4.666711699999999e-10 1.7164655e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.1e-06 -8e-07 -0.0 ] [ -5e-07 -4.8e-06 -1e-06 ] [ -5.5e-06 8.1e-06 1.03e-05 ] [ -3e-07 -1.4e-05 8e-07 ] [ 1.2e-06 1.14e-05 -1.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.17110076608e-15 -1.28174129664e-15 0.0 ] [ -8.010883104e-16 -7.69044777984e-15 -1.6021766208e-15 ] [ -8.8119714144e-15 1.297763062848e-14 1.650241919424e-14 ] [ -4.8065298624e-16 -2.24304726912e-14 1.28174129664e-15 ] [ 1.92261194496e-15 1.826481347712e-14 -1.618198387008e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }