{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7928542 3.8496636 7.9105646 ] [ -1.7691307 12.311172 -6.0620916 ] [ 5.0311416 -10.8062323 6.0289924 ] [ 11.9734521 -7.0215828 -4.0706035 ] [ -9.4426087 1.6669794 -3.8068619 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.281175566943087e-09 6.167841017864764e-09 1.26741216594481e-08 ] [ -2.834459846679538e-09 1.972467195304758e-08 -9.712541434668064e-09 ] [ 8.060777447454305e-09 -1.731349274999381e-08 9.659510670260883e-09 ] [ 1.918358502488867e-08 -1.12498158031714e-08 -6.521825760246653e-09 ] [ -1.512872689850268e-08 2.670795422035212e-09 -6.099265134794268e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4158558 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.67715754438408e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7546711 1.5636835 0.9472257 ] [ 3.3844695 1.7320438 4.6729203 ] [ 1.6728316 4.972099 2.939249 ] [ 0.6746688 3.7130355 1.4325993 ] [ 2.9600066 3.8649211 4.3457108 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.546711000000001e-11 1.5636835e-10 9.472257e-11 ] [ 3.3844695e-10 1.7320438e-10 4.672920300000001e-10 ] [ 1.6728316e-10 4.972099000000001e-10 2.939249e-10 ] [ 6.746688e-11 3.7130355e-10 1.4325993e-10 ] [ 2.9600066e-10 3.8649211e-10 4.3457108e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1728437 0.6227725 -0.0344181 ] [ 0.1765401 -0.1225694 0.1951632 ] [ 0.1791657 -0.2487852 0.1706286 ] [ -0.0421136 -0.5824956 -0.2523697 ] [ -0.1407485 0.3310777 -0.0790041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.76926135192569e-10 9.97791539577168e-10 -5.514387515235648e-11 ] [ 2.828484208536941e-10 -1.963778271054835e-10 3.126859162805146e-10 ] [ 2.870550957892665e-10 -3.985978310410522e-10 2.733771537598349e-10 ] [ -6.747342533772288e-11 -9.332608320388684e-10 -4.043408331383097e-10 ] [ -2.255039561126688e-10 5.304449506082361e-10 -1.265785219673453e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.591186 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.696895059574427e-18 } }