{ "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" [ [ 2.586158 0.6938923 0.8841089 ] [ 2.34485 2.26041 2.433738 ] [ 3.767171 2.568287 0.2210666 ] [ 4.342877 1.484782 1.999902 ] [ 4.214846 3.620834 1.934125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586158e-10 6.938923e-11 8.841089e-11 ] [ 2.34485e-10 2.26041e-10 2.433738e-10 ] [ 3.767171e-10 2.568287e-10 2.210666e-11 ] [ 4.342877e-10 1.484782e-10 1.999902e-10 ] [ 4.214846e-10 3.620834e-10 1.934125e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -31.9179845 -29.0520429 -39.3853792 ] [ -53.0537263 61.1901347 47.7652673 ] [ -16.6207563 5.7104054 -134.1088696 ] [ 125.01241 -111.5061172 69.0497597 ] [ -23.4199429 73.65762 56.6792218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.113824854895678e-08 -4.654650392085863e-08 -6.310233375558262e-08 ] [ -8.50014399241821e-08 9.803740323994282e-08 7.652839455432273e-08 ] [ -2.662938716387431e-08 9.149078027170074e-09 -2.148660955150358e-07 ] [ 2.002919606118641e-07 -1.786524940540248e-07 1.10629910663198e-07 ] [ -3.752288497485095e-08 1.180125167077705e-07 9.08101240530977e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 79.156369 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.268224837992179e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.5684821 0.456846 0.8368946 ] [ 1.7360143 2.5804286 2.642599 ] [ 3.6084283 2.82589 -0.493255 ] [ 5.0090949 0.9706005 2.3344355 ] [ 4.3338824 3.7944401 2.1522664 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5684821e-10 4.56846e-11 8.368946000000001e-11 ] [ 1.7360143e-10 2.5804286e-10 2.642599e-10 ] [ 3.6084283e-10 2.82589e-10 -4.93255e-11 ] [ 5.0090949e-10 9.706005e-11 2.3344355e-10 ] [ 4.333882400000001e-10 3.7944401e-10 2.1522664e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.31e-05 -9.6e-06 9e-07 ] [ -9.4e-06 3e-07 -5.8e-06 ] [ 1.6e-06 1e-07 6e-07 ] [ 1.33e-05 -1e-07 -3.2e-06 ] [ 7.7e-06 9.4e-06 7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.098851373248e-14 -1.538089555968e-14 1.44195895872e-15 ] [ -1.506046023552e-14 4.8065298624e-16 -9.292624400640001e-15 ] [ 2.56348259328e-15 1.6021766208e-16 9.6130597248e-16 ] [ 2.130894905664e-14 -1.6021766208e-16 -5.126965186560001e-15 ] [ 1.233675998016e-14 1.506046023552e-14 1.2016324656e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.147671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.946271447337016e-18 } }