{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.9606463 -2.345131 -4.6352374 ] [ -3.3617947 -4.1322947 5.6141401 ] [ 1.7519832 3.8598607 -1.8361505 ] [ -0.5703835 4.4343955 3.5797488 ] [ 3.7766797 -4.398375 -5.0434515 ] [ 4.3401325 2.0043414 2.6471989 ] [ -0.9759709 0.577203 -0.3262484 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.947831525918022e-09 -3.757314060913325e-09 -7.426468994137779e-09 ] [ -5.386188872269349e-09 -6.620665958595749e-09 8.994844014115775e-09 ] [ 2.80698652307437e-09 6.184178573084722e-09 -2.941837403370231e-09 ] [ -9.138551085900769e-10 7.104684797480727e-09 5.735389835696855e-09 ] [ 6.050907919589958e-09 -7.046973594511199e-09 -8.080500081438692e-09 ] [ 6.953658822674257e-09 3.211308931181541e-09 4.241280188187477e-09 ] [ -1.563677758561135e-09 9.247811520556224e-10 -5.227075590534067e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.087176 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.752731073894862e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6206459 1.8913626 2.2276866 ] [ 1.307658 1.7660633 4.5845807 ] [ 2.4037488 4.1799534 2.4854514 ] [ 2.4076014 3.8545237 4.89614 ] [ 3.8622242 1.2040776 1.8134582 ] [ 4.7429273 3.4011042 4.7998048 ] [ 4.6902624 3.3523512 2.4199993 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6206459e-10 1.8913626e-10 2.2276866e-10 ] [ 1.307658e-10 1.7660633e-10 4.5845807e-10 ] [ 2.4037488e-10 4.1799534e-10 2.4854514e-10 ] [ 2.4076014e-10 3.8545237e-10 4.896140000000001e-10 ] [ 3.8622242e-10 1.2040776e-10 1.8134582e-10 ] [ 4.7429273e-10 3.4011042e-10 4.799804800000001e-10 ] [ 4.6902624e-10 3.3523512e-10 2.4199993e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.86e-05 -4.6e-06 -1.35e-05 ] [ -1.36e-05 5.5e-06 2e-07 ] [ -2.8e-06 1.6e-06 8.8e-06 ] [ 1.37e-05 6.3e-06 8.6e-06 ] [ 5.4e-06 -1.17e-05 -6.3e-06 ] [ 3.6e-06 3.6e-06 -6.4e-06 ] [ -2.49e-05 -7e-07 8.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.980048514688e-14 -7.370012455680001e-15 -2.16293843808e-14 ] [ -2.178960204288e-14 8.8119714144e-15 3.2043532416e-16 ] [ -4.48609453824e-15 2.56348259328e-15 1.409915426304e-14 ] [ 2.194981970496e-14 1.009371271104e-14 1.377871893888e-14 ] [ 8.65175375232e-15 -1.874546646336e-14 -1.009371271104e-14 ] [ 5.76783583488e-15 5.76783583488e-15 -1.025393037312e-14 ] [ -3.989419785791999e-14 -1.12152363456e-15 1.393893660096e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.040115 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929039076474339e-18 } }