{ "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" [ [ 0.6305471 0.004372 1.304235 ] [ 0.7154426 1.383697 2.938133 ] [ 2.486494 1.164331 0.5043625 ] [ 2.840403 0.4835428 2.252778 ] [ 2.544628 2.936148 1.00011 ] [ 2.473494 2.502288 2.980444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.305471000000001e-11 4.372e-13 1.304235e-10 ] [ 7.154426000000001e-11 1.383697e-10 2.938133e-10 ] [ 2.486494e-10 1.164331e-10 5.043625000000001e-11 ] [ 2.840403e-10 4.835428e-11 2.252778e-10 ] [ 2.544628e-10 2.936148e-10 1.00011e-10 ] [ 2.473494e-10 2.502288e-10 2.980444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.019096 -7.0713768 -4.7415301 ] [ -13.6137191 1.5996709 5.1478008 ] [ -2.2511211 -14.360731 -32.7339433 ] [ 14.6271806 -22.8240147 19.4241905 ] [ -0.0989355 28.7480808 -8.409528 ] [ 7.3556911 13.9083709 21.3130102 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.643654889550797e-09 -1.132959458582752e-08 -7.596768673039486e-09 ] [ -2.181158246415842e-08 2.562955316954095e-09 8.247686090295537e-09 ] [ -3.60669359700958e-09 -2.30084274657978e-08 -5.24455586618528e-08 ] [ 2.343532678553932e-08 -3.656810274513553e-08 3.112098389706547e-08 ] [ -1.585121450671584e-10 4.605950295062936e-08 -1.347354915356298e-08 ] [ 1.178511631024663e-08 2.228366668939505e-08 3.414720666131193e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 22.762831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.647007565142148e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4873946 -0.1170406 1.2254399 ] [ 0.4517558 1.4342142 3.013834 ] [ 2.4717497 1.021705 0.1239232 ] [ 3.1421484 0.2050585 2.4625851 ] [ 2.5457189 3.2397507 0.8986461 ] [ 2.5922413 2.6906909 3.2556341 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.873946e-11 -1.170406e-11 1.2254399e-10 ] [ 4.517558e-11 1.4342142e-10 3.013834e-10 ] [ 2.4717497e-10 1.021705e-10 1.239232e-11 ] [ 3.1421484e-10 2.050585e-11 2.4625851e-10 ] [ 2.5457189e-10 3.2397507e-10 8.986461e-11 ] [ 2.5922413e-10 2.6906909e-10 3.2556341e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.5526915 2.0335598 0.8080788 ] [ 0.2704176 -0.7762877 -0.0430144 ] [ 0.1235832 0.7090892 1.2248332 ] [ -0.0312195 1.2917035 -0.4560581 ] [ 0.2281991 -2.1253274 1.7283508 ] [ -1.1436719 -1.1327374 -3.2621903 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.855093998148832e-10 3.258121968558724e-09 1.294684961124119e-09 ] [ 4.332567565728461e-10 -1.243750003954604e-09 -6.891666603773952e-11 ] [ 1.980021137636506e-10 1.136086138301775e-09 1.962399117419651e-09 ] [ -5.00191530130656e-11 2.069537148705533e-09 -7.306856255464685e-10 ] [ 3.656152629076013e-10 -3.40514987182565e-09 2.769123244300977e-09 ] [ -1.832364380045916e-09 -1.814845379785778e-09 -5.226605031260538e-09 ] ] } "relaxed-potential-energy" { "source-value" -17.877464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864285485999365e-18 } }