{ "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" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.9190056 -23.2972439 36.4061389 ] [ 62.452847 -42.9280049 -73.4513691 ] [ -82.3610628 14.7119195 15.0919486 ] [ -0.5627071 4.8028446 -57.4999729 ] [ 11.5795424 -20.6835859 1.6389303 ] [ 49.4781202 -17.7183886 31.2417025 ] [ -47.5057452 85.1124591 46.5726218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.108546910283515e-08 -3.732629981317903e-08 5.832906507973846e-08 ] [ 1.00060492190177e-07 -6.87782463950175e-08 -1.176820673073296e-07 ] [ -1.319569703695666e-07 2.357109366418896e-08 2.417996740844901e-08 ] [ -9.015561674059013e-10 7.695005394853076e-09 -9.212511303601322e-08 ] [ 1.855247226569228e-08 -3.313875803631186e-08 2.62585583141461e-09 ] [ 7.92726880786834e-08 -2.838798820705197e-08 5.005472575187938e-08 ] [ -7.611259494019765e-08 1.363651932323006e-07 7.461756643207901e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -34.83992527636716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.581971420810146e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1688 2.788884 1.320769 ] [ 2.532136 2.630615 3.81334 ] [ 3.448306 1.022917 2.319133 ] [ 4.871015 2.854538 3.444822 ] [ 3.148673 5.011898 0.914954 ] [ 4.462028 3.106005 1.382629 ] [ 3.536809 5.003724 3.350012 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1688e-10 2.788884e-10 1.320769e-10 ] [ 2.532136e-10 2.630615e-10 3.813340000000001e-10 ] [ 3.448306e-10 1.022917e-10 2.319133e-10 ] [ 4.871015e-10 2.854538e-10 3.444822e-10 ] [ 3.148673e-10 5.011898e-10 9.149540000000001e-11 ] [ 4.462028e-10 3.106005e-10 1.382629e-10 ] [ 3.536809e-10 5.003724e-10 3.350012e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.9190056 -23.2972439 36.4061389 ] [ 62.452847 -42.9280049 -73.4513691 ] [ -82.3610628 14.7119195 15.0919486 ] [ -0.5627071 4.8028446 -57.4999729 ] [ 11.5795424 -20.6835859 1.6389303 ] [ 49.4781202 -17.7183886 31.2417025 ] [ -47.5057452 85.1124591 46.5726218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.108546910283515e-08 -3.732629981317903e-08 5.832906507973846e-08 ] [ 1.00060492190177e-07 -6.87782463950175e-08 -1.176820673073296e-07 ] [ -1.319569703695666e-07 2.357109366418896e-08 2.417996740844901e-08 ] [ -9.015561674059013e-10 7.695005394853076e-09 -9.212511303601322e-08 ] [ 1.855247226569228e-08 -3.313875803631186e-08 2.62585583141461e-09 ] [ 7.92726880786834e-08 -2.838798820705197e-08 5.005472575187938e-08 ] [ -7.611259494019765e-08 1.363651932323006e-07 7.461756643207901e-08 ] ] } "relaxed-potential-energy" { "source-value" -34.83992527636716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.581971420810146e-18 } }