{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Es" "Es" ] } "a" { "source-value" [ 5.44841 5.083346 4.857093 4.692709 4.563523 4.457088 4.366578 4.287843 4.218167 4.155681 4.099037 4.047236 3.999516 3.955279 3.914051 3.87545 3.83916 3.80492 3.772512 3.741748 3.71247 3.684541 3.657842 3.63227 3.614861 3.596539 3.577203 3.556733 3.534988 3.5118 3.486963 3.460224 3.431267 3.399692 3.364976 3.326426 3.283089 3.233603 3.175933 3.106823 3.020582 2.90582 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.448410000000001e-10 5.083346e-10 4.857093000000001e-10 4.692709e-10 4.5635230000000004e-10 4.457088e-10 4.366578e-10 4.2878429999999997e-10 4.2181670000000003e-10 4.1556810000000006e-10 4.0990370000000004e-10 4.047236e-10 3.999516e-10 3.9552790000000003e-10 3.9140510000000004e-10 3.87545e-10 3.83916e-10 3.80492e-10 3.772512e-10 3.741748e-10 3.71247e-10 3.684541e-10 3.657842e-10 3.63227e-10 3.614861e-10 3.596539e-10 3.577203e-10 3.556733e-10 3.534988e-10 3.5118e-10 3.486963e-10 3.4602240000000005e-10 3.431267e-10 3.399692e-10 3.364976e-10 3.326426e-10 3.283089e-10 3.233603e-10 3.175933e-10 3.106823e-10 3.0205820000000004e-10 2.90582e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.800581 1.19821 1.5485 1.86928 2.16749 2.44743 2.71077 2.95833 3.19091 3.40897 3.61307 3.80301 3.97879 4.14079 4.28903 4.42321 4.54264 4.64706 4.73623 4.80984 4.86766 4.90957 4.93497 4.94352 4.93921 4.92473 4.89729 4.85307 4.78693 4.6919 4.55816 4.37201 4.11363 3.75361 3.2469 2.52137 1.45666 -0.160424 -2.74232 -7.16639 -15.6029 -34.8187 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.2826721612566848e-19 1.919744048808768e-19 2.4809704973088e-19 2.9949167137290243e-19 3.472701803817792e-19 3.921215127044545e-19 4.343132318366016e-19 4.739767162611264e-19 5.112401401076928e-19 5.461772035008577e-19 5.788776283313856e-19 6.093093710668608e-19 6.374724317072832e-19 6.634276929642433e-19 6.871783591909825e-19 7.086763650888769e-19 7.278111604710912e-19 7.445410887454848e-19 7.588276976731584e-19 7.706213197788673e-19 7.798851050003329e-19 7.865998272181057e-19 7.906693558349376e-19 7.920392168457217e-19 7.913486787221568e-19 7.890287269752385e-19 7.846323543277633e-19 7.775475293105856e-19 7.669507331406144e-19 7.517252487131521e-19 7.302977385865729e-19 7.004732207903809e-19 6.590761812621504e-19 6.013946185601088e-19 5.202107270075521e-19 4.0396800663864966e-19 2.333826596454528e-19 -2.5702758221521924e-20 -4.393680990752256e-19 -1.1481822513534912e-18 -2.499860159668032e-18 -5.578570710664896e-18 ] } }