{ "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" [ [ 1.331987 2.725643 2.897481 ] [ 2.736578 2.541304 1.125105 ] [ 1.73273 1.005545 4.481047 ] [ 2.473311 4.730527 2.221702 ] [ 3.99816 2.852734 3.21894 ] [ 4.698265 3.839392 1.5336 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.331987e-10 2.725643e-10 2.897481e-10 ] [ 2.736578e-10 2.541304e-10 1.125105e-10 ] [ 1.73273e-10 1.005545e-10 4.481047e-10 ] [ 2.473311e-10 4.730527000000001e-10 2.221702e-10 ] [ 3.99816e-10 2.852734e-10 3.21894e-10 ] [ 4.698265e-10 3.839392e-10 1.5336e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5965556 -0.0825484 0.9588557 ] [ 0.5692491 -0.0105256 -1.2813729 ] [ 0.0879543 0.4664151 -0.0976841 ] [ 0.4192997 -0.5264601 0.0558393 ] [ -1.4938211 -2.0526408 3.5242211 ] [ 1.0138737 2.2057598 -3.1598591 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.557874353273165e-10 -1.322571165644467e-10 1.536256185260818e-09 ] [ 9.120375994314413e-10 -1.686387023989248e-11 -2.052985702906696e-09 ] [ 1.409183231588294e-10 7.472793688080942e-10 -1.565071812438893e-10 ] [ 6.717921764484537e-10 -8.434820640040301e-10 8.946442098183743e-11 ] [ -2.393365242077739e-09 -3.288693100660208e-09 5.64642465295006e-09 ] [ 1.624404738583993e-09 3.534016782660484e-09 -5.062652375042128e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.757316279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.622060920096329e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2094437 2.6194524 2.7908158 ] [ 2.7719065 2.6839534 0.8735493 ] [ 2.1272023 1.3813088 4.5923258 ] [ 2.5631443 4.636649 2.321974 ] [ 3.602603 2.5313317 3.2545472 ] [ 4.6967312 3.8424498 1.6446629 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2094437e-10 2.6194524e-10 2.7908158e-10 ] [ 2.7719065e-10 2.6839534e-10 8.735493e-11 ] [ 2.1272023e-10 1.3813088e-10 4.5923258e-10 ] [ 2.5631443e-10 4.636649e-10 2.321974e-10 ] [ 3.602603e-10 2.5313317e-10 3.2545472e-10 ] [ 4.6967312e-10 3.8424498e-10 1.6446629e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.3e-06 1.12e-05 2.99e-05 ] [ -2.36e-05 -1.24e-05 -2.44e-05 ] [ -8.1e-06 5.4e-06 -4.32e-05 ] [ -1.1e-05 -2.63e-05 -4e-06 ] [ 3.8e-06 -3.6e-06 6.1e-05 ] [ 3.67e-05 2.57e-05 -1.94e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.68500622784e-15 1.794437815296e-14 4.790508096192e-14 ] [ -3.781136825088e-14 -1.986699009792e-14 -3.909310954752e-14 ] [ -1.297763062848e-14 8.65175375232e-15 -6.921403001856e-14 ] [ -1.76239428288e-14 -4.213724512704e-14 -6.4087064832e-15 ] [ 6.08827115904e-15 -5.76783583488e-15 9.773277386880001e-14 ] [ 5.879988198335999e-14 4.117593915456e-14 -3.108222644352e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.2267732790819394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.976390570767237e-19 } }