{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8231789 0.0357949 -1.0095534 ] [ 1.8707934 0.0680782 10.9018662 ] [ 1.8213774 1.2435685 -10.2261405 ] [ 2.6032857 7.1439044 -0.8918587 ] [ 0.941119 3.3677862 1.0338384 ] [ -4.7778732 -7.5981784 0.9829886 ] [ -4.2818811 -4.2609538 -0.7911405 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.921054609115861e-09 5.734975192387392e-11 -1.617482854929151e-09 ] [ 2.997341447826943e-09 1.090733004261466e-10 1.746671514872974e-08 ] [ 2.91816828793349e-09 1.992416377063325e-09 -1.638408323011602e-08 ] [ 4.170923485802962e-09 1.144579661091025e-08 -1.428915158197081e-09 ] [ 1.507838859190675e-09 5.395788313492873e-09 1.656391714165279e-09 ] [ -7.654996738186883e-09 -1.217362379314755e-08 1.574921353432923e-09 ] [ -6.860329791465386e-09 -6.826800560668919e-09 -1.267546812868022e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.5487709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.209446425175538e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1492545 0.9538811 2.0930092 ] [ 2.323483 4.1891225 1.5611546 ] [ 2.4274882 4.649192 3.7200943 ] [ 3.3183322 0.9203764 2.4636827 ] [ 4.6932406 1.991247 3.8105086 ] [ 3.7822399 3.4082381 0.1116525 ] [ 4.1221996 3.8333849 4.8748501 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1492545e-10 9.538811e-11 2.0930092e-10 ] [ 2.323483e-10 4.1891225e-10 1.5611546e-10 ] [ 2.4274882e-10 4.649192e-10 3.7200943e-10 ] [ 3.3183322e-10 9.203764000000001e-11 2.4636827e-10 ] [ 4.693240600000001e-10 1.991247e-10 3.8105086e-10 ] [ 3.7822399e-10 3.4082381e-10 1.116525e-11 ] [ 4.1221996e-10 3.8333849e-10 4.8748501e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0147499 -0.1483961 -0.1538336 ] [ -0.0545054 0.3673971 1.0145924 ] [ 0.0766342 -0.0094241 -0.8133198 ] [ 0.0292133 -0.0596155 0.0845506 ] [ 0.2024522 -0.3799992 0.0060958 ] [ -0.0411989 -0.0524899 -0.2860456 ] [ -0.1978455 0.2825278 0.1479601 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.363194493913792e-11 -2.377567620378989e-10 -2.464685974134989e-10 ] [ -8.732727758735232e-11 5.886350441697196e-10 1.625556222921362e-09 ] [ 1.227815235937114e-10 -1.509907269208128e-11 -1.303081968793732e-09 ] [ 4.680486627641664e-11 -9.551456033730241e-11 1.354649945946125e-10 ] [ 3.243641816695257e-10 -6.088258341627034e-10 9.766548245072642e-12 ] [ -6.600791438267712e-11 -8.409809060812992e-11 -4.582955728027085e-10 ] [ -3.169834346304865e-10 4.526594358860582e-10 2.370582130312301e-10 ] ] } "relaxed-potential-energy" { "source-value" -15.393629 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.466331249306889e-18 } }