{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5399091 -5.5963266 -1.3359926 ] [ -7.1923352 -11.5150083 -0.4382465 ] [ -15.3444761 6.9818239 10.7501409 ] [ -1.1310594 6.0467826 0.4798048 ] [ 2.0139466 0.0450248 -7.9738066 ] [ 16.7412515 -6.651366 7.6432933 ] [ 4.3727636 10.6890696 -9.1251932 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.650297373771693e-10 -8.966303640881153e-09 -2.140496109281806e-09 ] [ -1.152339130639689e-08 -1.844907708657795e-08 -7.021482964474273e-10 ] [ -2.458456086584436e-08 1.118611502312268e-08 1.722362442028587e-08 ] [ -1.812156927416076e-09 9.68801371278024e-09 7.687320331076198e-10 ] [ 3.22669815805965e-09 7.213768191619583e-11 -1.277544651330074e-08 ] [ 2.682244175623293e-08 -1.065666310158401e-08 1.224590583117728e-08 ] [ 7.005939608205243e-09 1.712577741122401e-08 -1.462017120532314e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -14.109731 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.2606281133977e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6050295 1.3987768 1.9882484 ] [ 2.4932938 0.2025704 4.038488 ] [ 2.0745493 2.4041442 5.2221936 ] [ 1.7226157 3.6024516 3.0934315 ] [ 4.1140841 1.0716 2.1332321 ] [ 4.4777267 1.8502394 4.6379477 ] [ 4.1671858 3.5261765 2.7622507 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6050295e-10 1.3987768e-10 1.9882484e-10 ] [ 2.4932938e-10 2.025704e-11 4.038488e-10 ] [ 2.0745493e-10 2.4041442e-10 5.2221936e-10 ] [ 1.7226157e-10 3.6024516e-10 3.0934315e-10 ] [ 4.1140841e-10 1.0716e-10 2.1332321e-10 ] [ 4.4777267e-10 1.8502394e-10 4.6379477e-10 ] [ 4.167185800000001e-10 3.5261765e-10 2.7622507e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3e-06 4.76e-05 7.4e-06 ] [ 2.39e-05 -1.63e-05 1.85e-05 ] [ -2.72e-05 -1.35e-05 4.9e-06 ] [ -1.09e-05 -1.32e-05 -9e-06 ] [ -3.7e-06 -1.65e-05 -2.5e-06 ] [ -4.6e-06 2.13e-05 -1.92e-05 ] [ 2.55e-05 -9.4e-06 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.8065298624e-15 7.626360715008e-14 1.185610699392e-14 ] [ 3.829202123712e-14 -2.611547891904e-14 2.96402674848e-14 ] [ -4.357920408576e-14 -2.16293843808e-14 7.850665441919999e-15 ] [ -1.746372516672e-14 -2.114873139456e-14 -1.44195895872e-14 ] [ -5.928053496960001e-15 -2.64359142432e-14 -4.005441552e-15 ] [ -7.370012455680001e-15 3.412636202304e-14 -3.076179111936e-14 ] [ 4.08555038304e-14 -1.506046023552e-14 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }