Appendix: Table of Core-Level Binding Energies978-3-540-35382-9/1.pdf · Appendix: Table of...
Transcript of Appendix: Table of Core-Level Binding Energies978-3-540-35382-9/1.pdf · Appendix: Table of...
Appendix: Table of Core-Level Binding Energies
This table lists binding energies (up to ~ 1500 eV) of core levels obtained from elements in their natural form using photoemission spectroscopy. Tile binding energies are given in electron volts [eV] relative to the vacuum level for tile rare gases and H2, N2, Oz, F2, C12: relative to the Fermi level for the metals; and relative to the top of the valence bands for semiconductors. Errors in the last digit(s) are given parenthetically as they have been quoted by the authors. Since these errors are in almost all cases (except for 1-40]) a mere measure of the precision of the measurements, we have tried to list whenever possible more than one binding energy to convey a feeling for the accuracy of the binding energies, in a number of elements only a few binding energies were obtai,led under UHV conditions from clean surfaces; we have then used the energy differences of Bearden and Burr [19] to derive the missing energies. For the elements P, CI, Zr, Nb, Ru, I, Hf, Os, and the radioactive elements Po through Pa we had to rely entirely on the compilation by Siegbalm et al. [22] because no new trustworthy data seemed to be available. These values arc set in parentheses. Electrons contributing to the valence bands or molecular orbits of a solid or molecule are marked "VE" (valence electrons). The spin-orbit splitting of levels, which can be measured more accurately than the absolute binding energies of the doublet components, are sometimes given behind the initials s.o.
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References
1 This is the vertical ionization potential. The adiabatic value is 15.45 eV. See D. H. Turner: Molecular Photoelectron Spectroscopy (Wiley-Interscience, New York 1970)
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~2 eV. The Co2p3/2 binding energy deviates by ~ + 1.5 eV from the trend observed for the series Ti through Ni. [.Compare Y. Fuk uda, W.T. Elam, R. L. Park : Phys. Rev. B 16, 3322 ( 1977)]
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384
34 Complex multiplet structure; for details see [.33] and also Y. Baer, G. Busch: Phys. Rev. Lett. 31, 35 (1973) Y. Baer, G. Busch: J. Electr. Spectr. 5, 611 (1974) S. P. Kowalczyk, N. Edelstein, F.R. McFeely, L. Ley, D.A.Shirley : Chem. Phys. Lett. 29, 491 (1974) F.R. McFeely, S. P. Kowalczyk, L. Ley, D.A.Shirley: Phys. Lett. 45A, 227 (1973) M. Campagna, G.K. Wertheim, Y. Baer: "Unfilled Inner Shells: Rare Earths and Their Compounds", Chap. 4 of this volume If a binding energy is given, it is that of the most intense peak or a member of the multiplet that is identified
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388 Additional References with Titles
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Subject Index
Page numbers in italics refer to Photoemission in Solids I: General Principles, Topics in Applied Physics, Vol. 26, ed. by M. Cardona, L. Ley (Springer, Berlin, Heidelberg, New York 1978)
Absorption coefficient 41 Alloys, concentrated 210 - edge 14,41 , dilute 206 - index 41 -, minimum polarity model 206 Acenes 268 - of transition metals 206 -, molecular orbitals 270 , virtual bound state model(Friedel-Anderson)
Adenine 280 206 AIN 23, 120
Adsorbates, alkali metals 43 -, synchrotron radiation experiments 341, AISb 21
343, 344 -, amorphous 101 Ag 194~201 -, critical points 59
- , w o r k function 49 -, core line asymmetry 225,228 -, 4d subshell-photoionization cross sections , XPS spectrum 57
315 Amorphous I II-V compounds 100-104
-, photoionization cross section 68 - group V semiconductors 104, 108 -, UPS spectra 199, 209 - group V] semiconductors 111-114
-, valence band spectra (XPS) 196 - semiconductors 41 Analysis, elemental concentration through core
-, work function 19 level intensities 80 AgBr 21,67-72 Angular asymmetry parameter (cross sections) AgCI 21,67-72 81 -, band structure 22 Angular resolution 242 -, partial density of states 71 Angular resolved photoemission
Agl 23, 67-72 (ARP, ARPES) 319, 237 -, band structure 22 - - -, conduction band states 333-335 -, partial density of states 69 - in metals 258-262 -, valence band spectra (XPS and UPS) 69, 70 - - - in semiconductors 249,254 259 Ag-O-Cs 6 - - - of surface states 139 AgPd alloys 210 - - orbital information 249 - , valence band spectra (XPS) 207 , valence bands of semiconductors - - , virtual bound state parameters 208 80-85
AgPt alloys, virtual bound state parameters Anodes 52 208 Anthracene 272 277
Ag2S 13 -, absorption spectrum 276 AI 9, 350, 149 -, Frenkel exciton 272,273 -, core level spectrum 359, 363 -, MO calculations 273 -, oxidized UPS spectra 343 -, photoemission spectrum 269, 273, 274, 276
-, photoabsorpt ion coefficient 149 - - , angle resolved 274
-, plasmons 359-361,363 Antifluorite structure 24 -, SXPS spectra (synchrotron radiation) 320 At, photoionizat ion cross section 68
-, valence band spectrum 369 -, solid UPS spectra (synchrotron radiation)
-, work function 39 332 -, yield spectrum and absorption spectra 323 Aromatic hydrocarbons 267
Alkali halides 124, 74, 76, I78 As, 104 metals 365, 366, 5 -, amorphous 105-107
390 Subject Index
As, orthorhombic 107
, photoabsorption cross section 154, 155 -, Raman spectrum 105 -, valence band spectrum 106
As2S 3 I I ,31 ,32 ,86 As4S 4, valence band spectrum (X PS) 110 As2Se 3 86,111 AszTe 3 32, 86,111 A7 structure 96, 104, 107 Asymmetry, core lines 352, 353, 15 Au 194 200. 202 -, 5d and 4.[ subshell photoionization cross
sections 315 , angular resolved PES 251 , core lines 207
-, photoionization cross section (photoabsorption) 45, 146, 147, 153, 154
- s tandard 13 AuAg alloy 210 AuAI 212 AuzAI 212 AuAI 2 212, 75
, yield spectrum 328 AuCu alloys 210 Auger decay 78~80
processes, interatomic 245 249,80 - spectroscopy 9, 15,60
spectrum, Na 365 AuPd alloys, virtual bound state parameter
2O8 Auo.t Pto, 9 75 AuSn 75 AuSn4 75
Back-bound, Si 140, 142 , S i ( l l t ) : H 153
Background in photoemission spectra (inelastic tail) 193, 354
Band bending 128. 133, 156, 24 - gap spectroscopy 319 - structure calculations 15-36 - , augmented plane waves (APW) 35, 44
- , bond, orbital model (BOM) I8, 22 - - -, empirical pseudopotential method
(EPM) 16, 19, 22, 25, 26, 29, 30 -- , empirical t ight-binding model (ETBM)
t7 -, orthogonalized plane waves [OPW) 32
- ,complex 90, 98 - of semiconductors 15
- - regime in photoemission, Ge 51 - , two-dimensional 32 39,255,256
tailing 115 -, photoemission spectrum a-Si 116
- width, 3delectrons 191
Ba, photoabsorpt ion cross section 157-159 -, photoionization t87-189 Be 350, 358 -, core level spectrum 357 - ,dens i ty of states 366 -, plasmon 357, 360 -, valence band spectrum 366 Benzene, UPS spectrum 269, 271 Bethe lattice 94,95 Beyond the one-electron picture 165 B i 1 0 4 , 105 -, amorphous 105
, photoabsorpt ion cross section 147, 148, 153, 154
-, Raman spectrum 105 -, spin-orbit splitting 105 -, valence band spectrum (XPS) 106 Bil 3 77 Binary alloys, stability 51 Binding energies, 4.f and 4d electrons in rare
earths 253, 254 , core levels 373, 60-70, 265
- - in ionic solids 73 - - in semiconductors 126-129
-, 5s and 5p electrons in rare earths 236
Bi2S % 32 BizTe 3 32 Black phosphorus structure 29, 107 Bond orbital model (BOM) 17, 18, 93 Bonding charge 118, 130 Born-Oppenheimer approximat ion 177 Brillouin zone, fcc lattice 83 Bulk incoming wave state 112
- outgoing wave components 11I, 12l, 123 Butane, UPS spectrum 267
CaB6 245 Calibration, energy 13 Catalysis, heterogeneous 153 Cd, core line asymmetry 228 Cd3As 2 24 Cdl 2 33 CdlnzS. ~ 26 CdS 23 -, band structure 23 CdSe 23 CdSnAs 2, vatence band spectrum (XPS) 60 Ce 235, 240, 252 -, 4J 'orbitals 235
,a-phase 237 -, ,,,-phase 237 -, ? ,~e transition 235 -, halides 238 --, photoionization cross sections 68, 157
, XPS spectrum 230, 237
Subject Index 391
CcAs, X P S s p e c t r a 241 ,251 ,252 C E L 43
see Electron energy losses
CcF 3 252 Ccnt ra l field a p p r o x i m a t i o n 136. 140 CeSb, XPSspech-a 241.251 253 C F 4 I79 CH 4 56, 179
, valence band spcc t rum (XPS) 267 C h a l c o p y r i t e c o m p o u n d s 24, 61, 70 Channe l t ron , channel plate 56 Charge densi ty waves ( C D W ) 36-38
• a m p l i t u d e 38 • c o m m e n s u r a t e 37
• - - , effect on core levels 38 , f i rs t -order phase t r ans i l ions 38 , i n c o m m e n s u r a t e 37. 39 , phase 38
. . . . . , R a m a n effect 38 - transfer 126 Charg ing , in organic c o m p o u n d s 262
• m pho toemiss ion 262, 13, 17 Chemica l po ten l ia l 33
shill 14, 60-75 of core levels of rare gases, imp lan ted in
noble meta ls 70 73 - shift in a l loys 74, 75 C h e m i s o r p t i o n 151,154,57 Clean ing by mil l ing, filing, b rush ing 59 Cleavage face, polar , n o n p o l a r 148 Cleav ing 58 Clusters , finite 98 Co 200, 179
, va lence band spec t rum [XPS) 20[ Coheren t po ten t ia l a p p r o x i m a t i o n 210, 211 Cohes ive energy 35, 36 C o m p a t i b i l i t y relat ions, z i ncb l ende -d i amond
20 C o m p o u n d s , l III VI 2 24 -, I I - I V - V 2 24
, I I3-V 2 24 • l l V I 19,23
-, I I -VI : valence band spectra (X PS) 57 • I I 1 V 19 • III V: valence band spect ra (XPS) 57
-, I I I - V I I 28 --, I l l 2 - V l ~ 24
, IV VI 62 -, IV-VI : valence band spect ra 63
,V2VI 3 30, 31 Conf igu ra t ion in terac t ion 14, 170, 182 186 - - final s tate (FSCI) 182-186 - - in the c o n t i n u u m (CSCI) 156, 182, 184,
187 - , ini t ial s ta te (ISCI) 182, 184, 189
Conse rwl t i on OfklL 53, I2/, 239, 254 257 C o n s t a n t final s tate spec t roscopy [CFS)
300• 314, 316, 317, 240, 260, 262 ini t ial state spec t roscopy (CIS) 2, 79, 300, 314, 317, 318
Con tac t po ten t ia l 4.13, 22 difference 150
C o n t a m i n a t i o n 265 ,57 ,58 Contmuousrandomnelwork 87, 99 C o O 183
• UPS spec t rum and par t ia l d-, p - componen t s 182
• valence band s p e c t r u m ( X P S ) 188 C o o p e r i n in imum 314, 315, 145, 156 Core exci tons 337-339, 9 - levels 60
, cross sect ions 8(I l ifetime 79, 80
, line a s y m m e t r y 353, 201,202, 205 . . . . Imc shape 353, 197 229 - re laxa t ion 14l, 152 - shifts 121, 126, 127, 129,60 75 - - ,effect of molecu la r po la r i za t ion 290,
291
- in charge transfer sal ts 288, 289 - in o rgan ic molecu les 288 293
- - , po ten t ia l model 288, 289, 6t, 64-70 - , s ingular i ty index 353, 354, 202, 204• 226
• spect ra of s imple metals 357 364, 210-224
width 76~0, 208 217 , v ib ra t iona l con t r i bu t i on 335, 76
- po la r i za t ion 167 Cor re l a t i on 16, 156, 18l 186 - energy 176, 191,224,35,36 - - , Ce 235
, i n t r a a tomic 257 - , in tershel l 250
, mtrashe l l 250 Cova len t gap 121 Cri t ical po in ts 52, 59, 65, 84, 8 - - , i n l e rband 41 Cr203 180 CHO3, UPS spectra and par t ia l d-,
p - componen t s 182,189 C H O 3, valence band spec t rum (XPS) 181 Cross section, par t ia l 68, 219, 271,367
- , p h o t o a b s o r p t i o n (pho to ion iza t ion ) 82, 83,136 I60
- - , , accura te ca lcu la t ions 149 159 , , C , S i , G e 55,56
Crysta l field sp l i t t ing 179 Cs coverage 87, 5, 17, 42, 43 C s P b B H 28 CsPbCI 3 28
392 Subject Index
Cs3Sb photocathode 12,6 8 Cu 194 201,315,8,87 89
, angular resolved photoemission 199, 258 -, core line 223
,densi tyofslates 175, 195 , photoionization cross section 68 • UPS spectrum 175, 195, 315, 87,89 , wllence band spcctrum (XPS) 175, 196, 197 • work function 38
CuBr 21,67 72 -, temperature effect on EDC 72
, wllcnce band spectrum (XPS) 71) CuCI 21,67--72
, valence band spectrum (XPS) 70 Cul 21,67 72
, valence band spectrum (XPS) 70 CuNialloys 206, 210 C'uo.c,2Ni0.,u, UPS spectrum 211 Cuo,,2Nio..~u, theoretical density of states 211 C u e 177, 192
, XPS spectrum 178 Cu20 177, 179, 192
,XPSspectra 178,185 CuF'd alloys, virtual bound state parameters
2(18 Cyclotron resonance 14 Cytosine 280
1)angIing bond 48, 114, 131, 140, 142, 145 o n G a A s 148 151 on Si charge density i44
- on Si density ofstates 146 l)ebye-Waller factor 81 Dedicated storage rings 309 Defect tetrahedral structures 24 Delayed absorption maximum 144, 146, 147
onset oftransitions 314 Density ofconduction states 42, 78
states 18, 88, 140 , cross section weighted 193, 221, 367,
368 - ,joint 369, 86 -- , one-dimensional 83, 198
- - - ,optical 41,42 • partial 46, 47, 50, 68 71, 73, 366 368
-- ,surface 137,140 143,145 147,150,194 DESY, experimental layout 312
- synchrotron, intensity compared with other sources 306
- , intensity distribution and brightness 304 Detailed balance theorems 123, 125 Diamond 11,/5 -, valence band spectrum(XPS) 56, 15 Dielectric constant 41 - -, longitudinal 44
Dipole acceleration 130, /39 approximation expression 137, 138
Dipole layer (surface) 32, 33, 38 -. length expression 139, 141
matrix element 138, 142 velocity expression 139
Direct transitions 53, 85• 87 Dispersion compensation 227, 12 Doniach-Sunjid shape 232, 240, 246, 355, 200,
206,232 Doping 133 DOR[S storage ring: intensity distribution and
brightness 304 DOS see Density of states Double quantum photoemission 276, 277 Dy, density of valence states 233 , valence band spectrum (XPS) 228,231,233
DySb, valence band spectrum(XPS) 241
Eclipsed configuration 23, 26 EDJDOS see Energy distribution of joint
density of states Effective electronlagnctic
field 119, 127 indcpendenl particlc sytcm 110
Effusion method (work function) 3I Einstein's law 3,135 Electrochemical potcntial 16 Electron affinity 17
, for Si 133 Electron escape depth {mean free path) 354,
362, 367, 2, 3, 8, 55, 57, 81, 92, 122• 125, 192, 193, 247
in organic materials 264, 283 - - for Si 49 - energy analyzers 9, 11, 55, 65, 241 244
, losses (CEL) 12, 40, 43 - , loss spectroscopy 132, 150
- mean free path, see Electron escape depth momentum parallel to surface 81,239, 247 spectrometer, calibration 57
, resolution 193,227, 228, 56 - storage rings 299 - synchrotrons 299
transport term iia pholocmission 174, 85, 91 Eleclronegativity 119,48, 5l
see also inside cover Electron-electron scattering 109 Electron-hole excitations 193, 350, 201, 202,
204 interaction effccts on core absorption 327
- pair production 53 Elemental analysis, composition determinalion
byXPS 59, 60
Subject Index 393
Energy band structure see Band structure distribution curves (EDC) 314, 2, 84-89
o f j o i n t d e n s i t y o f s t a t e s ( E D J D O S ) 174. 88, 23,~ gap 11 sum rule 175 transfer processcs{excitons) 275,339
Epitaxialf ihns 63 Equivalent cores approximat ion 70. 177 Er, UPS and XF'S spectra 233. 252 ErB., valence band spectra (XPS) 248 ErSb, valence band spectra (XPS) 24i ESCA 10, 12 Escape depth .see Electron escape depth
funclion 85 Etlmne, wdcnce band spectrum (XPS) 267 Eu 225, 252
chalcogenides 217, 238 -- wdence band spectrum (XPS) 232 EuO 218,238,254 • valence band spectrum(XPS) 219. 242• 76,
172 EuPI 2 252 EuRh 2 252 EuS 238 • UPSspect ra 73,218
EuTe, XPS spectrum I72 EXAFS see Extended X-ray absorption fine
structure Exchange energy 35,36,143 • Kohn-Sham-Gaspar 37 , S l a t e r 37, 143
splitting see Multiplet splitting Exciton annihilation (organics) 275 277 Excitonic shift in core hole absorption spectra
150, 337 Extended X-ray absorption fine structure
(EXAFS) 86, 136, 329
IAex, els m rare earths 217.22I - I , J o ] l a n s s o n scheme 237
• promotion energy 225, 236 FC-2 98 Fe 21)0--202. 169
, density of valence states 201 , soft X-ray emission spectrum 201
-, wdence band spectra 201 FeAI, absorption spectrum 329 FeAu alloys 210 FeCu alloys 210 FeF 2 181, 170
• valence band spectrum (XPS) 182 F%O, UPS spectra and parlial d-,
p-components 182 Fermi edge, in organic metals 287
Icvcl 14• 10.40 • pinning 134,137•154
stir/ace• two-dimensional 37 Ferronmgnetic metals: Fe. Co, Ni 200 Field emission 132
microscope 30 • photoassisled 4, 29.30• 129
Final state effects ill photoemission 78. 177. 188, 317• 333• 165
Flash evaporation 59 Floodgun•electron 13 Fluorescence yield 78 l:orm factor 89 Er:.lctionul parentage coefficients 181.
221 223, 240• 167 Frank-Condon diagram for NaCI 336
principle 335• 336. 76.77 Frenkelexci ton, inanatlu-acence 271,273•277
GaAs 40, 4,~, ' • amorphous 100, 101
densities of states of model s lruclules 101 • angular resolved PES 248. 261 ,band slruclure 19, 20, 49 • critical points 59 • density of stales 150 • electrorefleclance 43 , LEED 148 • oxidation 343 • photoabsorpt ion cross section 155 • photoemission spectrum 150 • reflectivity 42
- .surface 148 151 - relaxation 148. 149
,valencc band spectrum (XPS) 57. 58. 122 • yield spectrum 150
Gallium. photoabsorpt ion cross section 154. 155
GaN 23, 120 GaP 21
• amorphous 100,101,104 - EDC's 103
-, critical points 59 -. oxidation 343 • work function 49
Gap, indirect or direct 40 Gap states• photoemission spectrmn of
amorphous Ge 117 • amorphoussemiconductors 114 118
St, photoemission spectrum 116. I17 - , metal induced 155
GaS 26, 75 GaSb. amorphous 100. I01
• critical points 59 -. valence band spectrum (XPSI 57
• work function 49
394 Subject Index
GaSe 12.26, 75 • a n g u l a r r c s o l v e d PES 251.255,256 • band s t ruc ture 26 , charge d i s t r ibu t ion 26
G a S e 3 24 Gd, X P S s p e c t r u m 232, 233 G d B u 246 GdBa 246
• valence band spcctl urn IX PS) 247,249 GdS 217, 238
• UPS spec l rum 73 GdSb. X P S s p e c t r u m 241,247 Ge 14,40.315,47 G e l I I 97,98 G e l V 97, 98
, a m o r p h o u s 87 100 - densi ty 89
dielectr ic cons l an t 90 ,93 ...... UPS dcr iwl t ive spec t rum 117
- valence band spec t rum (XPS) 88 , band s t ruc ture 16, 18 • cha lcogen ides 107
a m o r p h o u s 107,108 , dens i ly of s la tes 88
, ox ida t ion 343 , po ly types 97, 98
, UPS cesiated 54 • valence band spectrurn (XF'S) 56 , work funcl ion 49
G e H 4 56 G e e 2 86 GeS 67 GeS, nearest ne ighbor d i s tance 125 GeSe 67 -, a m o r p h o u s 109 • nearest ne ighbor d i s tance 125
GeTe 29 • a m o r p h o u s 108, 109
, c r i t i c a l p o m t s 65, 66 , nearest ne ighbor d i s tance 125
UPS spec t rum 108 , valence band s p e c t r u m ( X P S ) 109
G % T e j ,. 86
G%Te~_~, valence band spectra (XPS) 109 Glasses 85, 86
Go lden rule 109, 125,140 G r a p h i t e 13, 179
, angu l a r resolved PES 255 , va lence band spec t rum (UPS) 270
Gray lin 17 Green ' s funct ions theory of pho toemis s ion
109, 115 G r o u p V e lements (As, Sb, Bi) 28,67 - , valence band spectra (XPS) 106
Hal l cffect 13
I l a r t r ee -Fock 187, 64, 65, 143, 150. 166, 174 -Slaler central f ield wave funct ions 143
t t ca t of formation 51 He-soul-co 9
Hete ro junc t ions 47 H e t e r o p o l a r g a p 102. 121 11[(2', ca lcula ted densi ty o f w l l e n c e s ta tes 190
• valence band spectra (XPS) 190 I-[IS 2 34, 35
• wllence band spectr tun (X PS) 74 Hg, p h o t o a b s o r p t i o n cross sect ion 154, /55 HgS, HgSe, HgTe, work function 49 He, valence band s p e c t r u m ( X P S ) 234 I lol:~,, valerlce band spec t rum (XPS) 248 IJoS, valence band spec t rum (X PS) 244 HoSb, valence band spec t rum (XPS) 241,244 H u b b a r d gap, o f N i O , C o O , M n O 188
-, o f V O 2 189 model 176,192
H u m e - R o t h e r y rule 104 Hund ' s rule 180, 181,225, 173 Husumi cactus lat t ice 94.95 Hybr id iza t ion , t empera tu re dependence 72,
76 H y d r o g e n c h e m i s o r b e d o n S i ( l l l ) 151-154 . . . . . densi ty of s tates 153
- - s t ruc ture 152 - - UPS spectra 153 I~lydrogenic a tom 143
Impur i ty scat ter ing, phase shirts 227 Ill, core level line shape 228
on St(l l I) surface pho toemiss ion spect ra 156
- - - band bending 156 , p h o t o a b s o r p t i o n cross sect ion 155
[nAs, a m o r p h o u s 101,103,104 • --, cri t ical po in ts 59
, valence band spect ra 58 • work function 49
Independen t par t ic le reduct ion of pho toemis s ion theory 109, 117, 119
Inelast ic processes see P l a smons Infrared ca t a s t rophe 179, 202 lnP, a m o r p h o u s 100,101
, cri l ieal po in t s 59 - , valence band spectra 58 -, work function 49 InSb, a m o r p h o u s 100 ,101 ,103 ,104 - , c r i t i c a l po in t s 59 - , ox ida t ion 343
• valence band spect ra 58 - , work function 49
S u h.icct Index 395
InSe, angular resolved photoemission spectrum 255,256
Insulator 11 lneTe 3 24 Intercalation 32 Interconfiguration fluctuations 235 Interface states 134,154
- .extrinsic 155 • metal-semiconductor 154
Interferencetermsinphotoionization 50 Intermediate valence (IV) 250, 254 lntermctallic compounds of transition metals
212 Internal conversion 10 I n ternational con ferences on amorphous
scmiconduetors I3 semiconductors 13
Ioffe-Regel rule 93 Ion bombardment 59 Ionicchargcs 120•121,/74
gap 121 Ionicity 21.118 125 ,critical 123, 125
of octet compounds 124 , pressure depcndencc 125
scale 119 - - based on XPS valence band spectra 121
, dielectric theory 119 -, Pauling 119
Ionization potential (photoemission threshold) 128, 133.17,25,49
Ion neutralization spectroscopy 132 lr, core line shape 229 Itinerant, electrons 192, 258
ferromagnet 202
Jellium model 33,34,43 Joint (optical) density of states 41, 86, 238
KBr valence band spectrum(XPS) 125 , work function 49
KCI, angular resolved photoemission • CIS spectra 318
- valence band spectrum (XPS) 125 -, work function 49
K=Cr20 7 180 • valence band spectrum (XPSt 181
Keldysh formalism 109 Kelvin method 17,22 KF valence band spectrum (XPS) 125 -, work function 49 KI,CIS spectra 321
valence band spectrum (XPS) 125 - ,work function 49
334
Kohn anomaly 38 variational principle 156
Koopmans 's tates 226 theorem 65~57, 174
Koster-Kronigtransitions 79 Kramers-Kronig analysis 42 Krogmann salt 36 Kr 177 . photoionization cross section 68
--. solid UPS spectra (synchrotron radiation) 332
K-TCNQ 282 . UPS spectrum 281
K. UPS spectra 369 . work function 38
K-edge (X-ray emission). Li 215 • AI. Mg 224
La 230. 240 ka. valence band spectrum (XPS) 230
halides 237• 238 • valence band spectra (XPS) 238
-. RAPW calculation 230 LaB~, 246 -. XPS spectrum 245 Langmuir 58 LaSb. XPSspectrum 239.241.251 253 Layer compounds 26. 32. 48. 72. 75. 251.
253-255 Lead chalcogenides see PbS. PbSe. PbTe LEED see Low energy electron diffraction Li 76,211-214 • work function 39
LiF, absorption coefficient and penetration depth vs angle of incidence 325
,coreexcitons 337 • cutoff 218 , refiectivity vs anglc of incidence 324
-, valence band spectrum (XPS) 183 • yield spectrum vs angle of incidence 325
Ligand chemical shift 1(14 Like-atom bonds 101 Linear alkanes 266
• valence band spectra (XPS) 267 Linewidth, phononcontr ibut ion 335, 15, 212,
215, 243 Liquid metals, yield spectra 329 Local density of states 99 Localized orbitals, photoemission 130
- slates 114,118 Loncpairs 31,111 Long range order 86• 114 Low energy electron diffraction (LEED) 132,
135, 141 144, 148, 151, 9,55, 117, 241, 253 Lu 152
396 Subject Index
Lu B,., valence band spectrum (XPS) Lz.~-X-ray edge, AI 223,224
, Mg 223 , Na 222
248
Madclungconstant 127 potcntial 62, 178
Mahan-Nozi6rcs-Dc Dominicis effect 40, 350, 198, 199
Many body features in photoemission 177 179, 193,352 354• 109, 117.165
perturbation theory 156 Mean free path, electrons see Electron escape
deplh Metal non-metal transition: VO: 188
semiconductor interface 154 Metals, d-band 192 206 , free electron like 357 369 • organic 280 287
Methane seeCH 4 Mg 350
, core level spectra 358,359, 190, 218 , density of states 368 , plasmons 358 362 , valence band spectrum(XPS) 368 • work function 39
Mg2Ge 24 MgO (:Ni) 183 MgzPb 24 Mg2Si 24 ,energy bands 26
-, valence band spectrum (XPS) 62 , X-ray emission spectrum 62
MgzSn 24 Mg2X (X=Si, Ge, Sn, Pb) 61 ,dcnsity of valence states 26
Microcrystal model of amorphous phase 86 Microfields 30 Mixed valence in rare earths 254 257• 172 Mn 169 MnF 2 168, 170 MnO 180, 183 , UPS spectra and partial d-, p-components
182 Mo, angular resolved photoemission
spectroscopy 261 , work-function 19
Mobility gap 114 Model densities of states for amorphous
semiconductors 94, 96 Modulation spectroscopy 12,14,40 Monochromatization, X-rays 227, I5,53 Monochromators for synchrotron radiation
311 Mooser and Pearson plot 123
Mortals, ordinary 9 MoS z 33, 34, 35,251.254
• UPS spectrum 73 MoTe 74 MoTe 2, UPS spectrum 73 Mottinsulator 176, 183 - t ransi t ion, Ce 235,237
, V O 2 188 Multichannneldetector 51 Muhidetecting systems 244.245 Multipletsplitting 14, 166, 174
- in rare earths 220, 223, 226. 234, 250• 171-173
, in tensi t iesa t l .5keV 218,219 in transition rnctals 179 183, 167-170
structure 143
Na 350 , absorption coefficient (EXAFS) 147, 148 , core level spectra 358, 210 , density of states 366, 368 , yield spectrum, absorption spectrum for 2p
transitions 330 Na2p linewidth vs temperature 337
• plasmons 358, 360, 361 , soft X-ray emission spectrum 365 • valence band spectra 365, 366, 368 , work function 38, 39
NaBr valence band spectrum(XPS) 125 NaCI 74, 77, 80
, constant final-stale spectra 338 ,coreexcitons 338 , surface core excitons 341--343
-, valence band spectrum (XPS) 125 , work function 49
NaF valence band spectrum(XPS) 125 Nal valence band spectrum(XPS) 125
, work ft, nction 49 Naphtalenc, UPS spectrum 269 -, vapor pressure 263 NbO 2 189 NbS2 34, 35 NbSe 2, UPS spectrum 73 Nb.lSn 212 Nd 230
• valence band spectrum (XPS) 230 NdB 6 246 • valence band spectrum (XPS) 247
NdBi, valence band spectrum (X PS) 244 NdS, valence band spectrum (X PS) 244 NdSb, valeece band spectrum (X PSI 244 Negative electron affinity 7, 25 Ne, solid, UPS spectra (synchrotron radiation)
332
Subject Index 397
Ni 200, 202 205 • angular resolved photoemission
spectroscopy 261 . angular resolved photocmission
spectroscopy, band dispersion 204 • bandwidth 202- 205 , core line 223
-. correlation energy 177 • density ofwllence states 204 • valence band spectra (XPS} 204
NiAI. absorption spectrum 329 NiO 176. 179. 183 187
• band-structure calculations 187 • UPS spectra and partial d-. p-components
182 • UPS spectra with synchrotron radiation
186 • wllence bands 187 • XPS spectra 184, 185
NiS 176 Noble metals 194. 200 Nonane, valence band spectrum (X PS'I 267 Nondi rec t t rans i t ions 83.92.314.262 Non-local pseudopolential 52
Occupied and en]pty stales in photoemission 33O
One-dimensional singularities 48, 198 Optical absorption 12, 40 Organometal l ic phenyl compotmds 270 272 Orlhogonal i ty catastrof, he 199 Orthogonalized plane waves {OPWl 16 Or thorhombics t ruc ture 107,111 Oxidation of AI. synchrotrorl radiation
spectroscopy 343 of Ge 52
Partial densities ofstatcs 12.67 72. 186. 366-369
Partial yield spectroscopy 79, 80 - spectrum of GaAs 80 Passive electrons 185 Patches 1&20.21 Pb 106 , core levels 22,~ , work ftlnction 39
Pbl 2 33 • valence band spectra 76
PbS 28 , angular resolved spectra 47
,cri t ical ionicity 125 -- points 65, 66
, valence band spectra 47, 63 PbSc, critical points 65, 66 • phase transition 126 , UPS spectra 63
PbTe• band structure 29 • critical points 65, 66 • phase transition 126 • valence band spectra 63, 65
Pd, core lines 232 -, valence band spectrum (XPS) and
theoretical density of stales 201 , work function 19
PdAg alloys 207 - . valence band spectra 207
, virtual bound state parameters 208 Pcierls transition 36 Pelticr effect 31 Penn model 123 Pentane. wdence band spectrum (XPSI 267 Phase shift, Coulomb 141
shills 199.201. 204. 219 • sumru le 199.219,226,227
Phononbrc, adening 335 337• 212.215 - in EuO 243
Photoabsorption measurements 135 Photocathode, solar blind 7 Photocathodes 6.7 Photoconduciivity, surface 132 Photoeffect. surface 3 Pholoeleclric cross seclioxls see Cross section
effect 3 -, surface vectorial 3.9
Photoelectron spectroscopy, complementary methods 40
Photoemission, angle resolved 80 85. 199. 204.4.9. 237-263
- - from surface 138 • formal theory 48, 105 131.252 254
from biological materials 278 280 - from organic rnolecularcrystals 262 - of semiconductor surface 130 -, three-step model ,'~4 92. 122 12& 247
threshold see Ionization potential , lime resolved 277
Photohole. localization 287, 356 Pholoionizat ion cross sections seeCross
sections Pholoyield near threshold 22 26 Phthalocyanmes 278,279 -- (H 2, Mg, Pb. Cu). UPS spectra 279 Physisorption 57 P i n n i n g o f E v i n S i 134,137 Plasmon frequm]cy 44
- dispersion 355, 356 Plasmons 45, 89, 351 369• 175, 189-191
,At 358 363,211 , Be 357, 360
and adsorbales 192 • energies 360
398 Subject Index
Plasmons, GaAs 45 , Ge 89
- , intr insic . extrinsic 191, 351, 352, 354. 357, 201,207
, L i 211 • Mg 358 363, 190, 217 • Na 358 363,216 , Si 89
-, surface 190, 356, 360, 363,367 • width 360
Polarization energy 74 shift 127,291
Polk model 87, 95, 98 density of states I00
Polytypes ofGc, Si 9% 98 Porphyrin 279 F'ositron annihilat ion 34 Potential model for core level shifts 127, 69, 70 Propane, wflence band spectrum (XPS) 267 Pr, valence band spectrum (XPS) 230 Pseudopotenlial method 17, 246 Pt, core line 231 • valence band spectrum (XPS) and theoretical
density ofstates 201
Quadrat ic response 106 Quant izeddescr ipt ion of radiation 114 Quantum efficiency (yield) 6, 27, 130
Racah method 221 Radial distribution function 86 Random phase approximation{RPA) 119,156 Rarcear th boridcs 245. 249 - - ,4[ l i fe t imc 249
- , in tera tomicAuger transitions 245 . . . . , s t ructure 245 - , valence band spectra (XPS) 245,
247 249 chalcogenides 238 243
- -- fluorides 171 - halides 237, 238
mtcrmetallics 249 . . . . ions, divalent 221
, t r ivalcnt 221 metals 229 237,174
- pniclides 238-243 Rare earths, 3d and 4de lec t rons 251 253 - -, photoabsorptiou cross sections 158,, 159
trifluorides 234, 237, 238 Rare gas line source 52
solids 330 333 • valence bands 330--333
Rcferencingofbindingencrgics 128, 13 Reflectance, normal incidence 43
Reflection and transmission amplitudes for photoen'dssion spectroscopy 125
Refractive mdcx 41 Rehltivistic dehybridization 105 Relaxation 37, 118, 174
energy 127• 267, 63, 64, 68, 69, 71,72, 118, 175-132 • 41electrons 226, 253
m anthracene 273 - , ex l r aa tomic 63,177
m free molecules 17,'~ in metals 180
, intraatomic 63,176 of k-conservation 92 processes 337 341
Renormalization energy 70, 71, 75 Renormalized atom scheme 22l, 225, 237 RcO 3 176, 189, 190 • calculated density of slates 190 , valence band spectrum (XPS) 190
Resolution 227, 52 Richardson plot 20 Rigid band model 36, 206 Rings• fivefold 97-99
, odd-,nembered 98, 100 , sixfold 95,96,98, 107
R-matrix theory 156 Rotating anodes 227 RusselI-Saunders coupling 221
S, monoclinic 111 ,o r thorhombic II1,112 • -, valence band spectrum (XPS) 113
-, Ss rings 112 Sample preparation 228,229, 57 Satellites 177
• charge transfer 177 , core levels 76,141,175
-, Kotani-Toyozawa 179 - ,multielectron peaks 184, 185, 182 189 -, shake up/off 226, 252, 182-189 Sb 104 ~, amorphous 105
Raman spectrum 105 , - , wdence band spectrum {X PS) 106
Sb2Se 3 I l I Scattering time 53,90 92 Schotlky Barrier 134, 154-156
- effect 21 Screening of core holes 204
see a/.so Relaxation Se 30, 86
, amorphous 112 -- dielectric constant 90
valence band spectrum II0
Subject Index 399
• an i so t ropy in abso rp t ion coefficient 326, 327
• -, energy bands 30 - • m o n o c l i n i c 31,113
valence band s p e c t r u m ( X P S ) 113 -, Ses r ings 31 .112 ,113 Secondary e lec t rons 79, 127• 264
, ene rgy d i s t r ibu t ion 85
in organic c o m p o u n d s 264 Secondary emiss ion processes 319,320 Self-energy of the electron 117 - of the electron, imag ina ry par t 118
S e m i c o n d u c t o r s II • a m o r p h o u s 85 118
surfaces 130 158 Semimeta l s 11,104 Shake-off see Satel l i tes Shake -up see Satel l i tes Shor t range o rde r 87 Si 14 S i l l 97 ,98 Si 2H-4, densi ty of s ta tes 99 S i / l l 97, 98 Si, a m o r p h o u s 87 100
- calcula ted dens i ty o f s t a t e s 91 dielectr ic cons tan t 90, 92 fihns 89 wdencc band spect ra 88, 92 valence band speclra, gap states I I6, 17
, BC-8, densi ty of s ta tes 99 • densi ty of s la tes 88, 99 • electron affinity 133
-, ioniza t ion potent ia l (pho toemiss ion threshold) 133. 134• 143, 46
. o x i d a t i o n 343 - , pho to ion i za t i on cross sect ion 68
, po ly types 97, 98 densi t ies o f s t a t e s 99
-, ST-I 2, densi t ies of s ta tes 99 surface, band bending 138
, chcmisorbed hydrogen 151-154 - - hydrogen densi ty of s la tes 153
- - , pho toemis s ion spectra 153 , e L e c t r o n i c s t r u c t u r e 141,147
-, geomet ry 142 and In pho toemiss ion spect ra 155
• p inn ing o f E v 137 . . . . , r e laxa t ion 142
states, charge densi ty 144 - - , d e n s i t y o f s l a t e s 145 147 - - - , e lect ronic theory . . . . , pho toemis s ion 136. 138. 140, 146, 147 - stales, pho toemiss ion , angle resolved
139 - , un recons t ruc ted 146
, y i c l d s p e c t r u m 133• 135, 140 • vacancies 153
valence band spec t r a (XPS) 56, 88 , X-ray enl iss ion spec l rum 46 , w o r k function 133, 134, 143,49
SiC 23 S i l l 4 56 Simple metals 349 370, 34, 38
SiO, SiO 2 86 Slatcr integrals F and G 224. 250. 16¢~
S m 225. 240. 252. 173 • X P S s p e c t r u m 231,251
SINAI 2 173 Smal l angle sca t te r ing 89 SmB, , .va lence band s p e c t r u m ( X P S ) 247,251 SmS 237, 258 S m S b • X P S s p e c t r u m 239, 242• 251 SmTe. X P S s p e c t r u m 239, 242. 251 Sm~_~Y.,S 255 Sn, core levels 228
, p h o t o a b s o r p t i o n cross sect ion 155
(SN)., 280, 285,287 , band d i spers ion 286 • band s t ruc ture 285 • UPS spec t rum 286
- - , a n g u l a r resolved 286 SnS 67 SnS 2 33, 75 SnSc 67 SnSe 2 75
• wdence band spec l rum (XPS) 76 S n f e 29
• cri t ical ionici ty 125 • cri t ical po in ts 65, 66
- , valence band spec t rum (XPS) 63 Space charge layer 132 134, 14
Spin-orbi t sp l i t t ing 21 ,29 ,67 , Bi 105 , core levels 43 , m r a r e c a r t h s 234
- of 4d e lec t rons 251 - of vir tual bound s ta tes 208
, PbS, PbSc, PbTe 84 • reversal 21
Spin po la r i za t ion : bulk vs surface 203 - in EuS 217
in Ni 202 • polar ized pho toemiss ion 257, 2 ,9
in E u O a n d Eu t ,Gd. ,O 258 Sput te r ing 58• 59
Staggered conf igura t ion 23 Step edges, S i su r facc 138, 146 S t ick ing coefficient 58
Stone r -Wobl f ah r t model 200,202, 2(13 S torage r ings and synchrc, t rons ava i lab le 308
400 Subjcct Index
Structure fuelor 89 Sudden approximation 175 Sum rule, Lundquist 175,181
• Manne und Aberg t,W Superionic conduclors 21 S u rface chemistry ofsemicond uctors 151
effects a! threshold 26, 27 phase transitions 257• 46 photoelectric effect 3, 9. 262 plasmons 130, 190 reconstruction 132. 148,46 relaxation 46 48, 132, 14g resonance 131, 140, 129 sensitivity of photoemission 192 stnles 9, 14,44.47.51, 122• 12g
• l l l -Vcompounds 14g 151 • effects in photoemission 12& 129
of GaAs 149 GaAs, density of slates 151) GaAs. energy loss 150 GaAs, excitonic shift 150 GaAs. UPS spectrum 150 GaAs, yield spectrum 150
of Si 133,134 Si, dens i tyofs ta tes 145 147 Si. dispersion 139 £i, inflared spectroscopy 144 Si. UPS speclrum 136, 13g 140. 146.
147 , synchrotron radiation cxpcrimenls
341 343 transition lerrn in photoernission 174, 126
Surfaces, semiconductor 130 150 SXPS, sofl X-ray photoemission spectra 174 Synchrotron radiation 43. 44. 51, 205, 218,
299 344 • angular emission pattern 301 , available or projected sources 308. 309 • compared with olher sources 305. 306,
9, 54 .255 ,260 , 262 , its uses 299 • Inboratory layout 311 • monochromators 311,313 , polarization 302 • properties 301 305 • spectroscopic techniques 313
TaC, calculated density of states 190 , valence band spectrum (X PS) 190
Tantalus I, Experimental Iayoul 31l "I'aS 2 35,39
• angular resolved UPS spectrum 253, 254
• t.lPS spectrum 73 TaSc 2 38
• angular resolved UPS spectrum 254
TbB,. valencc band spectrum (XF'S) 247 Tb. vulence band spectrum(XPS) 234 TCNQ. molecular orbitaIculculat ion 281
. UPS spectrum 281 Te 30. 3I
• amorphous 112.113 • wtlence bund speclrum (XPS) 110 . wflence band spectrum 110
Terrace site. S i ( l l l ) 138.146 Tetracene. UPS spectrum 263• 269
• wlpour pressure 263 TetrahedraI coordination, semiconductors 18 Tetraphenyl tm (Ph.~Sn) 271
• partial cross sections 271 • photoemission spectrum 271
Th B~, 246 • valence hand spectrum (XPS) 245
Theory of photoemission, independent particle model 105 131
Thermionic emission 4, 19, 10,~ Thermionicemit ters 7 Thomas-Fcrmirnodel 34. 143 Three step model 351, ,'¢, 84 ,~>9, 190 Thymine 280 Tight-binding method (LCAO) 17 TiO 2, wdence band spectrum (X PSI 185 TiS 2 35
, valence band spectra 73, 74 TiSe 2 35
• allgtll~lr resolved UPS spectrum 255 TICI 28 Tm 240, 252
• wflence band spectrum (XPS) 234 TmB,,. valencc bands spectrum (XPS) 248 TmSb. valence balms spectrum {XPS) 241 TmSe, valence band spectra 255 Transistor 14 Transit ional metal, chlorides 188
compounds 176 191 diehalcogenides 32, 33, 36, 72 75
• stacking modifications 33, 34 . fluorides 188 • oxides 183 191
metals 192 206,45, f67, 170 operator method 67 69 potential model 70 probabilily, dipole 7& 138
Transitions. direct 8 .25 .26 • indirect b;. 25.26
Transmission probabili ty 174./25 Trklecane. valence band spectrum (XPS) 267 TSeF 285
• UPS spectrum 284 TTF, molecular orbi ta lcalculat ion 282
• UPSspec l rum 281. 284
Subject Index 4 0 1
TTF-TCNQ 280,281•287 -, charge transfer 280• 281 • core level spectra 292• 293 • wtlence band spectrum 281 , valence charges, self-consistent calculation
291
Ultra high wlctmm 58 Unfillcd inner shells: rare carlhs and
cornpounds 217 -- : transilion metal compounds
UPS regime 174 t lr ical 28(1 IJS, IJPS spectrum 73
173
Vacancies 114 • Sill 1 I ) surface 153
Vacuum incoming w.qve components I11 state I I I , II2, 117, 121
level 16 Valence chargcs, effect of molccuhu
pohuization 290, 291 Van Vleck expression fnr multiplel splitting
166,/69, 171 Vapor deposition 58,59 Vapor pressure, elements 59 Virtual bound stale parameters of transition
metal alloys 208 VO= 176, 188
• valence band spectra (XPS) 183 Voids 89. 114 Volume effects in photoemission 129, 131) Vohlme limit ofphotoemission 122 Volume photoemiss ion:angular integrated 47
V3Si 212
W anguhu" resolved UPS spectrum 260, 261 Wigglers 307 Wigner-Seitz cells (sphcrcsl 32, 33, 35
radius 220 WO 3 189 Work function 3, 16
determination, break point of retarding potential curve 22
-, cMorimetric method 31 - ,effusion method 31
• electron bcarn method 22 - , field emission 29
-- -, Fowler plot 24 • isochromat method 27 • Kelvin method 22
-, photoyicld near threshold 23
, thermionicemission 19 - - -, threshold of EDC 2~
-, lotal photoelectric yield 2,'¢
• semicondtlclors, insulators 4 6
- , t e m p e r a t u r e d e p e n d c l m c 21.41, 42 - , theory 32, 40
• t r a n s i t i o n m e t a l s 44• 45 • volume dependence 41, 42
Wrong bonds 100, 11,)2 Wurtzite 23
X~ cluslcr calculati(ms 34•~57 Xe in Ar• UPS spectra 333 Xe-doped Ar, yield speclra 340
No. UPS spectra 340 Xe-likc ions 186 Xenon, photoionization cross section 68. 144,
145• I52 155, 157 ,solid. UPS spectra (synchrotron radiation)
332 XPS 10, t2
, ar~guhu- resolved /6,249 252 regime 51.62,67. 174
X-ray absorption edge. vibrational broadening 76
spectroscopy 10 edge 198
anomaly set, Mahml-NoziOrcs- De Dominicis effect
threshold exponent 198, 199, 201, 204, 223. 224 emission spectroscopy 40.45 47, 10
X - r a y s • m o n o c h r o n ~ a t i z e d 12
Yb 225, 240, 252 , wllence band spcctrum (X PSI 234, 256
YbAI3, valence band spectrum (X PSI 256 YbTe 243 Yield spectroscopy 80, 150,263. 322 330
• applications 326 • oblique incidence 323
YM~ anodes(sourccs) 54 YS 243
• valence band spectrum IXPS) 244
Zn3As z 24 ZnGeP 2 24
• charge distributions 61 , density of valence states 25,60 , energy band strtlclure 25 • valence band speclrum (XPS) 60
ZnO 11.23 ZnS 23 ZnSe, valcncc band spcclrmnlXPS) 122 ZrC, calculated density of states 190
, valence band speclrum (XPS) 190
Z r S 2 34 ZrS=, valence band spectra 73, 74