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523-14
Wave functions• Shells • Orthogonality
523-14
Effect of other electrons in neutral atoms• Consider effect of electrons in closed shells for neutral Na • large distances: nuclear charge screened to 1 • close to the nucleus: electron “sees” all 11 protons • approximately:
• lifts H-like degeneracy:
• “Far away” orbits: still hydrogen-like!
0 1 2 3 4 5
r [a.u.]
!20
!15
!10
!5
0
V(r
) [
a.u
.]
Sodium
�2s < �2p
�3s < �3p < �3d
523-14
Example: Na• Fill the lowest shells
• Use schematic potential
• Ground state: fill lowest orbits according to Pauli
• Excited states?
H0 |n⇤m�ms� = �n� |n⇤m�ms�
|300ms, 211 12, 211� 1
2, ..., 100 1
2, 100� 1
2i ⌘
|�0(Na)i
523-14
Closed-shell atoms• Neon
• Ground state
• Excited states
• operators: see later
• Note the H-like states
• Splitting?
• Basic shell structure of atoms understood ⇒ IPM
|�0(Ne)i = |211 12, 211� 1
2, ..., 100 1
2, 100� 1
2i
|n` (2p)�1i = a†n`a2p |�0(Ne)i
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Periodic table
HF
Σ(2)F-RPA
523-14
Level sequence (approximately)
523-14
Hydrogen again• Relevant references for factorization technique
– Am J Phys 55, 913 (1987)
– Am J Phys 46, 658 (1978)
• Factorization with the aim to go to momentum space! • Consider before
• Hamiltonian
• It is also possible to write before
p =�p · p r =
�r · r
rp =1
2
�1
pp · r + r · p1
p
⇥pr =
1
2
�1
rr · p+ p · r 1
r
⇥
H =p2
2m� �2
ma0
1
r
�2 = p2�r2 � r2p
⇥�2 = r2
�p2 � p2r
⇥
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Detour (artificial)• Define “funny” operator
• When acting on eigenstate of Hamiltonian same effect as applying the operator
• Proof requires to show that
• Then it follows immediately that • Goal is now to factorize the “funny” operator
� = r2�p2 � 2mE
⇥2 � 2i�p · r�p2 � 2mE
⇥+ 4�2
�p2 � 2mE
⇥
H |E�m� = E |E�m�
r2�p2 � 2mH
⇥2
r2�H,p2
⇥=
2i�3ma0
(p · r + 2i�) 1r
� |E�m� = 4�4a20
|E�m�
523-14
Development• Works by defining
• Use to replace in and use • Inserting and replacing the square of the orbital angular
momentum by its eigenvalue, one finds
• Check that
• Note
• As before implies that the energy doesn’t change
P±� = rp
�p2 � 2mE
⇥± i�
�+ 12 ± 1
2
p
�p2 + 2mE
⇥
�� = P��±1P
±� � 4�2
��+
1
2± 1
2
⇥2
2mE
�� |E�� = 4�4a20
|E��
��±1
�P±� |E��
⇥=
4�4a20
�P±� |E��
⇥
P±� |E�� = p±E� |E�± 1�
�2 = p2�r2 � r2p
⇥r2 p · r = rpp� 2i�
�� = r2p�p2 � 2mE
⇥2+
�2�(�+ 1)
p2�p2 � 2mE
⇥2 � 2i�rpp�p2 � 2mE
⇥
�
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More development• Normalization
• For bound states factor must break off for
• With the usual solutions with
• Go to momentum representation with • apply to
• insert and note phase choice!
��p±E�
��2 =4�4a20
⌅1 +
⇥�+
1
2± 1
2
⇤2 2ma20�2 E
⇧
1 + (�max + 1)22ma20�2 E = 0
En = � �22ma20
1
n2n = �max + 1
rp = i��
�
�p+
1
p
⇥
P±� |E�� = p±E� |E�± 1�
E
⇥p| rp�p2 � 2mE
⇥± i�
�+ 12 ± 1
2
p
�p2 + 2mE
⇥|n�⇤ = 2�2
a0i
⇤1�
(�+ 12 ± 1
2 )2
n2
⌅1/2⇥p|n�± 1⇤
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Differential equation in momentum space• Final result
• For use upper result (rhs --> 0)
• Solution
⇤p2 +
�2a20n
2
⌅d
dp⇤p|n�⌅+
⌥⇧±⇤�+
1
2± 1
2
⌅+ 3
⌃p+
�2a20n
2
1
p
⇧1⇥
⇤�+
1
2± 1
2
⌅⌃�⇤p|n�⌅ =
2�a0
1�
��+ 1
2 ± 12
⇥2
n2
⌦1/2
⇤p|n�± 1⌅
� = �max
⇤�p2 +
�2a20n
2
⇥d
dp+ (n+ 3) p+
�2a20n
2
1
p(1� n)
⌅⇥p|n� = n� 1⇤ = 0
⇥p|n⇥ = n� 1⇤ = �n�=n�1(p) = Npn�1
�p2 + �2
a20n
2
⇥n+1
523-14
Ground state• Normalization
• Other wave functions: use lowering operator • Ground state wave function
|N |2 =24n+2(n!)2
�(2n)!
��
a0n
⇥2n+3
⇥10 = 4
⇧2
�
⇤�a0
⌅5/2 1�p2 + �2
a20
⇥2
523-14
Direct knockout reactions• Atoms: (e,2e) reaction • Nuclei: (e,e’p) reaction [and others like (p,2p), (d,3He), (p,d), etc.] • Physics: transfer large amount of momentum and energy to a
bound particle; detect ejected particle together with scattered projectile → construct spectral function
• Impulse approximation: struck particle is ejected • Other assumption: final state ~ plane wave on top of N-1 particle
eigenstate (more serious in practical experiments) but good approximation if ejectile momentum large enough
• If relative momentum large enough, final state interaction can be neglected as well
• -> PWIA = plane wave impulse approximation • Cross section proportional to spectral function
523-14
(e,2e) data for atoms• Start with Hydrogen • Ground state wave function • (e,2e) removal amplitude
⇥1s(p) =23/2
�
1(1 + p2)2
�0| ap |n = 1, ⇤ = 0⇥ = �p |n = 1, ⇤ = 0⇥ = �1s(p)
Hydrogen 1s wave function “seen” experimentally Phys. Lett. 86A, 139 (1981)
523-14
Helium• IPM description is very successful • Closed-shell configuration • Reaction more complicated than for Hydrogen • DWIA (distorted wave impulse approximation)
agreement with IPM! → 1
1s2
Phys. Rev. A8, 2494 (1973)
S =⇥
dp����N�1
n | ap |�N0 ⇥
��2
523-14
Other closed-shell atoms• Spectroscopic factor becomes less than 1 • Neon removal: S = 0.92 with two fragments each 0.04 • IPM not the whole story: fragmentation of sp strength • Summed strength: like IPM • IPM wave functions still excellent • Example: Argon S = 0.95 • Rest in 3 small fragments
2p
0 1 2 3 p (a.u.)
0.0
0.4
0.8
1.2
1.6
2.0
Diff
eren
tial c
ross
sect
ion
(10−
3 a.u
Argon
3p
3p
523-14
Fragmentation in atoms• ~All the strength remains below (above) the Fermi energy in
closed-shell atoms • Fragmentation can be interpreted in terms of mixing between
• and
• with the same “global” quantum numbers • Example: Argon ground state • Ar+ ground state • excited state • also • and
a� |�N0 �
a�a⇥a†⇤ |�N0 �
|�N0 � = |(3s)2(3p)6(2s)2(2p)6(1s)2�
|(3p)�1� = a3p |�N0 � = |(3s)2(3p)5(2s)2(2p)6(1s)2�
|(3s)�1� = a3s |�N0 � = |(3s)1(3p)6(2s)2(2p)6(1s)2�
|(3p)�24s� = a3pa3pa†4s |�N
0 � = |(4s)1(3s)2(3p)4(2s)2(2p)6(1s)2�|(3p)�2nd� = a3pa3pa
†nd |�N
0 � = |(nd)1(3s)2(3p)4(2s)2(2p)6(1s)2�
523-14
Argon spectroscopic factors• s strength also in the continuum: Ar++ + e • note vertical scale • red bars: 3s fragments exhibit substantial fragmentation
8%
523-14
(e,e’p) data for nuclei• Requires DWIA • Distorted waves required to describe elastic proton scattering at
the energy of the ejected proton • Consistent description requires that cross section at different
energy for the outgoing proton is changed accordingly • Requires substantial beam energy and momentum transfer • Initiated at Saclay and perfected at NIKHEF, Amsterdam • Also done at Mainz and currently at Jefferson Lab, VA • Momentum dependence of cross section dominated by the
corresponding sp wave function of the nucleon before it is removed
523-14
Inclusion of SO potential and magic numbers• Sign of SO?
• Consequence for
• Noticeably shifted • Correct magic numbers!
V�s
�� · s
�2
⇥r201r
d
drf(r)
0f 72
0g 92
0h 112
0i 132
V�s = �0.44V
523-14
Neutron levels as a function of A
• Phenomenological! • Calculated from Woods-
Saxon plus spin-orbit
523-14
Momentum profiles for nucleon removal • Closed-shell nuclei • NIKHEF data, L. Lapikás, Nucl. Phys. A553, 297c (1993)
523-14
But...• Spectroscopic factors substantially smaller than simple IPM
523-14
Remember• 208Pb sp levels
0f
523-14
Fragmentation patterns• 208Pb(e,e’p) NIKHEF data: Quint thesis
• S(2s1/2)=0.65
• other data: • n(2s1/2)=0.75
• very different from atoms
523-14
Fragmentation patterns• 208Pb(e,e’p) NIKHEF data: Quint thesis
• start of strong fragmentation • also very different from atoms
523-14
Fragmentation patterns• 208Pb(e,e’p) NIKHEF data: Quint thesis
• deeply bound states: strong fragmentation • again different from atoms
523-14
16O data from Saclay• Simple interpretation! • Mougey et al., Nucl. Phys. A335, 35 (1980)
Moment
um
Energy
523-14
Recent Pb experiment• 100 MeV missing energy • 270 MeV/c missing momentum • complete IPM domain
SRCalso LRC