{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.570437 1.678388 2.565083 ] [ 2.924882 3.183881 4.210831 ] [ 1.144354 3.791418 3.165706 ] [ 4.144212 1.310941 0.7169232 ] [ 4.636642 2.415393 2.866782 ] [ 3.821758 3.649635 1.198039 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.570437e-10 1.678388e-10 2.565083e-10 ] [ 2.924882e-10 3.183881e-10 4.210831e-10 ] [ 1.144354e-10 3.791418000000001e-10 3.165706e-10 ] [ 4.144212e-10 1.310941e-10 7.169232e-11 ] [ 4.636642e-10 2.415393e-10 2.866782e-10 ] [ 3.821758e-10 3.649635e-10 1.198039e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.6870121 -8.1410089 -0.1457578 ] [ 0.5547784 2.5487998 6.1451111 ] [ -2.6588092 1.9194431 -0.8166593 ] [ 0.9809342 -3.6888539 -5.0476909 ] [ 7.9498132 1.0297041 4.2897926 ] [ 0.8602955 6.3319159 -4.4247957 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.231595107042671e-08 -1.304333412930472e-08 -2.335297394592423e-10 ] [ 8.888529822048307e-10 4.083627450659716e-09 9.845553336638571e-09 ] [ -4.259881939407952e-09 3.075286859775877e-09 -1.308432437618894e-09 ] [ 1.571629841783151e-09 -5.910195476126902e-09 -8.087292349004911e-09 ] [ 1.273700484876724e-08 1.649767835361905e-09 6.873005411800846e-09 ] [ 1.378345337079446e-09 1.014484761985179e-08 -7.08930422235637e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.617336 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.397787789578189e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8423515 1.1525875 2.0795502 ] [ 3.09176 3.635929 4.4623594 ] [ 1.3419053 3.0302077 3.1981377 ] [ 3.3665867 1.6077315 0.4994549 ] [ 4.9943708 3.2396475 3.3442496 ] [ 4.6053107 3.3635529 1.1396123 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8423515e-10 1.1525875e-10 2.0795502e-10 ] [ 3.09176e-10 3.635929e-10 4.462359400000001e-10 ] [ 1.3419053e-10 3.0302077e-10 3.1981377e-10 ] [ 3.3665867e-10 1.6077315e-10 4.994549e-11 ] [ 4.994370800000001e-10 3.2396475e-10 3.3442496e-10 ] [ 4.605310700000001e-10 3.3635529e-10 1.1396123e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.36e-05 1.46e-05 -5.4e-06 ] [ -1.14e-05 -4.5e-06 8.4e-06 ] [ -1.29e-05 7.6e-06 7.5e-06 ] [ -3.2e-06 -8.9e-06 -6.3e-06 ] [ 8.9e-06 2e-06 -1.57e-05 ] [ -5.1e-06 -1.08e-05 1.15e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.781136825088e-14 2.339177866368e-14 -8.65175375232e-15 ] [ -1.826481347712e-14 -7.2097947936e-15 1.345828361472e-14 ] [ -2.066807840832e-14 1.217654231808e-14 1.2016324656e-14 ] [ -5.126965186560001e-15 -1.425937192512e-14 -1.009371271104e-14 ] [ 1.425937192512e-14 3.2043532416e-15 -2.515417294656e-14 ] [ -8.17110076608e-15 -1.730350750464e-14 1.84250311392e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.766631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.725004447298053e-18 } }