Results for the Delta test:
This is a list of results obtained by calculating the inputs of the DFT-Delta-project.
Element | V'0' [A'^3^'/atom] | B'0' [GPa ] | B'1' [-] |
---|---|---|---|
H | 17.48708 | 10.32618 | 1.524 |
He | 17.96132 | 0.76801 | 6.479 |
Li | 20.25229 | 13.76785 | 3.349 |
Be | 7.90706 | 123.26275 | 3.316 |
B | 7.24069 | 237.27958 | 3.459 |
C | 11.63566 | 209.37915 | 3.663 |
N | 28.87756 | 52.30153 | 2.530 |
O | 18.54643 | 49.83280 | 3.019 |
F | 19.18025 | 35.01605 | 5.626 |
Ne | 24.93847 | 1.26441 | 10.672 |
Na | 37.09442 | 7.71858 | 3.621 |
Mg | 22.93776 | 36.10742 | 4.063 |
Al | 16.49541 | 76.56406 | 4.360 |
Si | 20.46280 | 88.51818 | 4.340 |
P | 21.47023 | 74.22347 | 3.384 |
S | 17.23335 | 83.41044 | 4.163 |
Cl | 38.91818 | 18.98732 | 4.570 |
Ar | 52.60197 | 0.71241 | 8.863 |
K | 73.66943 | 3.58944 | 3.789 |
Ca | 42.23417 | 17.33311 | 3.469 |
Sc | 24.62511 | 54.59137 | 3.439 |
Ti | 17.39538 | 112.19200 | 3.590 |
V | 13.46918 | 184.15675 | 3.910 |
Cr | 11.80977 | 184.12846 | 7.278 |
Mn | 11.48927 | 122.56790 | 1.076 |
Fe | 11.38511 | 197.58030 | 3.644 |
Co | 10.88524 | 219.43366 | 5.322 |
Ni | 10.90478 | 202.17268 | 5.059 |
Cu | 11.97243 | 141.14923 | 5.088 |
Zn | 15.21979 | 75.19882 | 5.358 |
Ga | 20.31091 | 48.30167 | 5.271 |
Ge | 23.92641 | 59.09065 | 4.991 |
As | 22.61678 | 68.50040 | 4.296 |
Se | 29.79100 | 47.31347 | 4.630 |
Br | 39.48292 | 22.43363 | 4.779 |
Kr | 66.26136 | 0.61958 | 10.392 |
Rb | 91.06577 | 2.79906 | 3.806 |
Sr | 54.49266 | 11.28285 | 4.542 |
Y | 32.86062 | 42.02735 | 1.790 |
Zr | 23.40400 | 93.59103 | 3.100 |
Nb | 18.16337 | 168.66244 | 3.233 |
Mo | 15.80606 | 259.11211 | 4.433 |
Tc | 14.44972 | 300.10101 | 4.553 |
Ru | 13.78305 | 313.16207 | 4.916 |
Rh | 14.06152 | 258.23357 | 5.246 |
Pd | 15.33228 | 169.30042 | 5.735 |
Ag | 17.84375 | 89.57434 | 5.954 |
Cd | 22.89463 | 43.60423 | 7.093 |
In | 27.58217 | 34.81952 | 5.579 |
Sn | 36.85537 | 35.85623 | 4.720 |
Te | 34.99872 | 44.73450 | 4.676 |
I | 50.27411 | 18.71699 | 5.223 |
Sb | 31.75640 | 50.56640 | 4.570 |
Xe | 86.92016 | 0.56256 | 7.631 |
Cs | 116.61774 | 1.95855 | 3.306 |
Ba | 63.20920 | 8.88254 | 3.167 |
Lu | 29.05199 | 47.00055 | 3.775 |
Hf | 22.54373 | 107.88188 | 3.124 |
Ta | 18.29010 | 189.93752 | 3.421 |
W | 16.15312 | 303.71300 | 4.465 |
Re | 14.97209 | 364.93026 | 4.596 |
Os | 14.29502 | 399.58389 | 4.766 |
Ir | 14.50475 | 349.95035 | 5.100 |
Pt | 15.62711 | 250.40575 | 5.834 |
Au | 17.94405 | 137.35814 | 5.337 |
Hg | 29.76849 | 9.98230 | 8.085 |
Tl | 31.35182 | 27.37905 | 5.404 |
Pb | 31.98720 | 39.65112 | 4.823 |
Bi | 36.92233 | 42.64721 | 4.822 |
Po | 37.59827 | 45.14631 | 5.365 |
Rn | 93.21815 | 0.49964 | 8.101 |