{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0809782 -4.0364851 -1.9742768 ] [ -0.9146635 -5.1746283 6.8984107 ] [ -3.811413 6.8383931 -7.0110644 ] [ 0.9705444 1.2963596 1.4334474 ] [ 1.7633177 -0.4817198 -0.8379037 ] [ -0.9776688 -1.6938068 0.6031227 ] [ 2.888905 3.2518873 0.8882641 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.297413788344666e-10 -6.467162057427551e-09 -3.163140131947837e-09 ] [ -1.465452475599101e-09 -8.290668483590048e-09 1.105247234421656e-08 ] [ -6.10655680081319e-09 1.095631354866004e-08 -1.123296346860318e-08 ] [ 1.554983547128364e-09 2.07699704326964e-09 2.296635911426546e-09 ] [ 2.825146393982828e-09 -7.718002013364518e-10 -1.342469718621817e-09 ] [ -1.566398094245591e-09 -2.713777655112061e-09 9.663090894137722e-10 ] [ 4.628536050712224e-09 5.210097805536435e-09 1.423155974115953e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.235333 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.081840082590273e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.507003 1.7174428 1.9638202 ] [ 2.7240396 2.5966113 4.3054857 ] [ 2.2414768 4.1993359 2.2342858 ] [ 4.7465883 2.8008745 2.2803987 ] [ 5.1875139 2.7910732 4.7492576 ] [ 4.4604829 5.205732 1.6287935 ] [ 4.0206515 4.9119523 4.0831144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.507003e-10 1.7174428e-10 1.9638202e-10 ] [ 2.7240396e-10 2.5966113e-10 4.3054857e-10 ] [ 2.2414768e-10 4.1993359e-10 2.2342858e-10 ] [ 4.746588300000001e-10 2.8008745e-10 2.2803987e-10 ] [ 5.1875139e-10 2.7910732e-10 4.7492576e-10 ] [ 4.4604829e-10 5.205732000000001e-10 1.6287935e-10 ] [ 4.0206515e-10 4.911952300000001e-10 4.083114400000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.2e-06 2e-06 -6.3e-06 ] [ 9e-07 -5.9e-06 1.91e-05 ] [ -2.14e-05 -5e-07 -9.5e-06 ] [ 1e-05 -6.8e-06 -2.01e-05 ] [ -4.7e-06 -7.2e-06 1.25e-05 ] [ 4.2e-06 1.8e-06 -1e-07 ] [ 7.8e-06 1.67e-05 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.126965186560001e-15 3.2043532416e-15 -1.009371271104e-14 ] [ 1.44195895872e-15 -9.45284206272e-15 3.060157345728e-14 ] [ -3.428657968511999e-14 -8.010883104e-16 -1.52206778976e-14 ] [ 1.6021766208e-14 -1.089480102144e-14 -3.220375007808e-14 ] [ -7.53023011776e-15 -1.153567166976e-14 2.002720776e-14 ] [ 6.72914180736e-15 2.88391791744e-15 -1.6021766208e-16 ] [ 1.249697764224e-14 2.675634956736e-14 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -23.608362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.782476565178313e-18 } }