{ "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" [ [ 0.8784497 0.4697805 1.02237 ] [ 0.3714623 2.027429 0.7033507 ] [ 0.1687176 1.823848 2.813644 ] [ 2.523837 0.1233038 2.780688 ] [ 2.720424 2.179791 0.2128499 ] [ 1.955613 2.373981 2.741889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.784497e-11 4.697805e-11 1.02237e-10 ] [ 3.714623e-11 2.027429e-10 7.033507e-11 ] [ 1.687176e-11 1.823848e-10 2.813644e-10 ] [ 2.523837e-10 1.233038e-11 2.780688e-10 ] [ 2.720424e-10 2.179791e-10 2.128499e-11 ] [ 1.955613e-10 2.373981e-10 2.741889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7562418 -27.1098923 -7.6313367 ] [ -11.2426941 14.8352349 -13.7866938 ] [ -14.4139534 3.2203651 11.2149386 ] [ 5.7465341 -5.6513066 2.4926462 ] [ 6.0966292 3.1556006 -4.507974 ] [ 14.5697259 11.5499982 12.2184197 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.211632931631709e-09 -4.343483563546594e-08 -1.222674924619302e-08 ] [ -1.80127816418261e-08 2.376866652085623e-08 -2.208871848448831e-08 ] [ -2.309369915078067e-08 5.159593673660254e-09 1.796831242862748e-08 ] [ 9.206962585649969e-09 -9.054391311492737e-09 3.993659465565961e-09 ] [ 9.767876769926607e-09 5.055829505902452e-09 -7.222570549974259e-09 ] [ 2.334327420844424e-08 1.850513708632208e-08 1.957606638646215e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 9.204608 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.474740774122865e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.918025 -0.4101506 0.8923085 ] [ 0.2341577 1.8385192 0.4520214 ] [ 0.0089054 2.5419552 2.8111782 ] [ 2.5048054 -0.0982098 2.6580397 ] [ 2.4889057 2.8492037 0.5282374 ] [ 2.4637044 2.2768157 2.9330064 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.18025e-11 -4.101506e-11 8.923085e-11 ] [ 2.341577e-11 1.8385192e-10 4.520214e-11 ] [ 8.905400000000002e-13 2.5419552e-10 2.8111782e-10 ] [ 2.5048054e-10 -9.82098e-12 2.6580397e-10 ] [ 2.4889057e-10 2.8492037e-10 5.282374e-11 ] [ 2.4637044e-10 2.2768157e-10 2.9330064e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.12e-05 2.2e-06 3.6e-06 ] [ 6e-07 8.4e-06 8.2e-06 ] [ 9.3e-06 1.3e-05 -1.24e-05 ] [ 7.9e-06 -1.83e-05 -3e-06 ] [ -1.43e-05 -7.8e-06 1.12e-05 ] [ -1.47e-05 2.6e-06 -7.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.794437815296e-14 3.52478856576e-15 5.76783583488e-15 ] [ 9.6130597248e-16 1.345828361472e-14 1.313784829056e-14 ] [ 1.490024257344e-14 2.08282960704e-14 -1.986699009792e-14 ] [ 1.265719530432e-14 -2.931983216064e-14 -4.8065298624e-15 ] [ -2.291112567744e-14 -1.249697764224e-14 1.794437815296e-14 ] [ -2.355199632576e-14 4.16565921408e-15 -1.217654231808e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9625962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435966209331092e-18 } }