F

Fluorine

Element	Configuration	Total Energy
F	\(1s^2 2s^2 2p^5\)	-99.096686

Kinetic Energy

Kohn-Sham	Thomas-Fermi	von Weizsacker
98.674282	-	72.136099

Eigenvalues

\(f_{nl}\)	\(n\)	\(l\)	\(\varepsilon_{nl}\)
2.0	\(1\)	\(0\)	-24.18930634
2.0	\(2\)	\(0\)	-1.08668300
5.0	\(2\)	\(1\)	-0.41545071

external potential, \(v_{\rm ext}\), v_ext
Hartree potential, \(v_{\rm H}\), v_h
Hartree-xc potential, \(v_{\rm Hxc}\), v_hxc
Kinetic energy density, \(\tau_{\rm s}\), tau
Pauli potential, \(v_\theta\), vtheta

Non-self-consistent kinetic energy

Density	Hartree-Fock
Basis	Slater-type functions
Integration grid	Double exponential
Fractional occupation	Yes
Units	Hartree atomic units

Configuration

\(1s^2 2s^2 2p^5\)

Kinetic Energy

Functional	Spin-polarized	Spin-unpolarized
ref	99.4093493060000	99.4093493060000
TsKS	99.4093534668210	99.4093534668210
TF	90.2084453506344	90.0621886648756
W	73.1733835216543	73.1311079014452
GEA2	98.3388212974849	98.1878673205918
GEA4	99.9320274811976	99.7790900947944
TFW	163.381828872288	163.193296566320
TF5W	104.843122054965	104.688410245164
P82	96.1540301647751	96.0154369228428
DK87	98.4328928056408	98.3026165254837
LLP	98.6904249206150	98.5436529430334
OL1	99.2134131858200	99.0621304117776
OL2	98.9919731196720	98.8400678762743
P92	98.3548743958064	98.2039114320836
T92	98.8478714103060	98.7037666850479
LC94	98.8317571674828	98.6842890442922
LP97	102.555281618686	102.389006770047
VJKS00	96.0795500679067	95.9465576933766
E00	99.3684251914112	99.2114110678785
TW02	98.8107712426417	98.6649698746405
PBE2	164.771859933602	164.631190430869
PBE4	133.289812023600	133.301917033687
MGGA	99.3515874197665	99.2089501877407
GDS08	80.7238675482604	80.6662745713259
RDA	99.3084432409974	99.2340857341180
APBEK	98.9656302084201	98.8200574707230
revAPBEK	99.4875981190951	99.3407395715973
VT84F	156.098679982342	155.930763063593
L04	99.9610933390102	99.8046251979699
L06	99.8125454315822	99.6563409672354
revMGGA	108.373451654360	108.219787236314
revMGGAloc	100.660235410061	100.503923942483
TFLreg	99.0477733998267	98.9015124605280
LGAPGE	100.059195531657	99.9056535898881
LGAP	99.2362959433558	99.0880268245018
MVT84F	89.1568849308677	89.0536045341973

Disclaimer:

To the best of our knowledge, the information contained herein is accurate and reliable as of the date of publication; however, we do not assume any liability whatsoever for the accuracy and completeness of the above information.