{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.5159529 -6.0925947 1.8518082 ] [ -0.6617426 0.4917444 -2.8142593 ] [ -0.4282526 0.5505324 2.2863894 ] [ 3.4290985 6.0955347 -0.3521393 ] [ 0.6318199 -0.5196371 0.4302616 ] [ -0.4180858 0.5961831 -0.8343417 ] [ -0.0368845 -1.1217628 -0.5677189 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.031000948624538e-09 -9.76141286877224e-09 2.966923828689598e-09 ] [ -1.060228531442408e-09 7.878613875803496e-10 -4.508940492477195e-09 ] [ -6.861363091697483e-10 8.820501475399416e-10 3.663199672905279e-09 ] [ 5.494021492384448e-09 9.766123268076198e-09 -5.641893583731162e-10 ] [ 1.012287080676216e-09 -8.325504197795213e-10 6.893550820274544e-10 ] [ -6.698472997671971e-10 9.551906324056852e-10 -1.336762776511838e-09 ] [ -5.9095484056773e-11 -1.797262147050415e-09 -9.095859562601825e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.614662 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.98239765062077e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7482565 0.527518 2.6728686 ] [ 1.228396 2.3632918 2.6231921 ] [ 1.537954 2.7222923 4.9363438 ] [ 3.5255333 2.8470491 2.2088829 ] [ 3.0659724 0.8959828 5.0471133 ] [ 4.8299666 1.3330427 3.506251 ] [ 3.8432691 3.2155103 4.5831233 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7482565e-10 5.27518e-11 2.6728686e-10 ] [ 1.228396e-10 2.3632918e-10 2.6231921e-10 ] [ 1.537954e-10 2.7222923e-10 4.936343800000001e-10 ] [ 3.5255333e-10 2.8470491e-10 2.2088829e-10 ] [ 3.0659724e-10 8.959828e-11 5.0471133e-10 ] [ 4.8299666e-10 1.3330427e-10 3.506251e-10 ] [ 3.8432691e-10 3.2155103e-10 4.5831233e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.83e-05 5e-06 1.69e-05 ] [ 8.3e-06 1.7e-05 1.4e-06 ] [ 1.6e-06 -2.79e-05 -6.7e-06 ] [ 8.3e-06 1.38e-05 -3.56e-05 ] [ 1.86e-05 -3.2e-06 8.2e-06 ] [ -3e-06 -1.16e-05 1.35e-05 ] [ -1.54e-05 6.8e-06 2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.93198324022e-14 8.010883169999999e-15 2.70767851146e-14 ] [ 1.32980660622e-14 2.723700277799999e-14 2.2430472876e-15 ] [ 2.5634826144e-15 -4.470072808859999e-14 -1.07345834478e-14 ] [ 1.32980660622e-14 2.21100375492e-14 -5.703748817039999e-14 ] [ 2.98004853924e-14 -5.1269652288e-15 1.31378483988e-14 ] [ -4.806529901999999e-15 -1.85852489544e-14 2.162938455899999e-14 ] [ -2.46735201636e-14 1.08948011112e-14 3.5247885948e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.43874 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.434864829040116e-18 } }