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PB Karadakov's Publications
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| Chemistry |
- N. Tyutyulkov, B. Galounska and P. Karadakov, Phase
Transitions in p-Polyphenyls, Commun. Dep. Chem. Bulg. Acad. Sci. 12 (1979) 534-538 (in Bulgarian).
 
- P. Karadakov, O. Castaño, F. Fratev and V. Enchev, Some
Contributions and Generalizations to the Electronic Theory of
Even Polyenes and Annulenes, Chem. Phys. Lett. 78 (1981)
560-565.

- O. Castaño and P. Karadakov, On the HMO Treatment of Systems,
Built from Repeating Units, Math. Chem. MATCH 11 (1981)
87-95.

- P. Karadakov, V. Enchev, F. Fratev and O. Castaño,
Electronic Structure of Möbius Annulenes,
Chem. Phys. Lett. 83 (1981) 529-532.

- P. Karadakov and B. Galounska, Band Structure of Infinite
Polyacenes, C. R. Bulg. Acad. Sci. 34 (1981)
1681-1683.

- O. Castaño and P. Karadakov, Local States in Polyenes and
Annulenes: Single Substitutions, Z. Phys. Chem. Neue Folge
126 (1981) 205-216.

- P. Karadakov, O. Castaño, F. Fratev and V. Enchev,
Electronic Structure and Aromaticity of
(AB)N-Heteroannulenes, Z. Phys. Chem. Neue Folge
128 (1981) 169-178.

- P. Karadakov and O. Castaño, A Resolvent Approach to the
Electronic Structure of Systems, Constructed of Chain
Fragments: Branched Polyenes, J. Chem. Soc. Faraday Trans. 2
78 (1982) 73-80.

- P. Karadakov and O. Castaño, Application of the Resolvents
of Some Simple Linear Operators to the Study of Local Vibrations
and Local Electronic States in One-Dimensional Chains, J.
Mol. Struc. THEOCHEM, 90 (1982) 115-125.

- P. Karadakov and O. Castaño, Instabilities of the
Symmetry-Adapted Hartree-Fock Ground State in Infinite
Polyenes: I. Singlet Instabilities, Int. J. Quantum
Chem. 22 (1982) 351-365.

- O. Castaño and P. Karadakov, Instabilities of the
Symmetry-Adapted Hartree-Fock Ground State in Infinite
Polyenes: II. Nonsinglet Instabilities, Int. J. Quantum
Chem. 22 (1982) 367-383.

- P. Karadakov and O. Castaño, A PPP-Investigation of
Structural Isomerism in Infinite Polyenes, Z. Naturforshung
37a (1982) 28-32.

- P. Karadakov and O. Castaño, New Derivation of
(In)Stability Conditions for Projected Hartree-Fock Solutions,
Int. J. Quantum Chem. 22 (1982) 1033-1036.

- O. Castaño and P. Karadakov, Local States in
One-Dimensional Homonuclear Chains, Zh. Fis. Khim. 57
(1983) 1155-1157 (in Russian).

- P. Karadakov and O. Castaño, Stability Properties of
Closed-Shell Restricted Hartree-Fock Solutions for Electronic
Systems in the Framework of the Projected Hartree-Fock Method
and Their Utilization, Int. J. Quantum Chem. 24 (1983)
453-457.

- P. Karadakov and O. Castaño, An Analytical Approach to
Monoexcited CI for Infinite Polyenes in the Hubbard
Approximation, Chem. Phys. Lett. 106 (1984) 280-285.

- F. Fratev, V.Enchev, P. Karadakov and O. Castaño, A
Classification of Polyenes into 4L + 2- and 4L-Classes on
the Basis of Coulson's Bond-Orders and Information Theory and
Its Application to the Interpretation of Electrocyclic
Reactions, Int. J. Quantum Chem. 26 (1984) 993-1015.

- P. Karadakov, An Extension of the Pairing Theorem, Int. J. Quantum Chem. 27 (1985) 699-707.

- P. Karadakov and O. Castaño, Inestabilidad de las
soluciones de Hartree-Fock del tipo de capa cerrada dentro de la
aproximacion de la teoria de geminales, Fol. Chim. Theor. Lat. 13 (1985) 111-123 (in Spanish).

- P. Karadakov, The Spin-Projected Hartree-Fock Method: Direct
Optimization Schemes and Stability Conditions, Int. J. Quantum Chem. 30 (1986) 239-264.

- P. Karadakov and O. Castaño, Aromaticity of Annulenes and
Annulene Ions with 4l + 2 Electrons from the Viewpoint of the
Theory of Hartree-Fock Instabilities, Theor. Chim. Acta 70
(1986) 25-34.

- O. Castaño and P. Karadakov, The Spin-Unrestricted and the
Spin-Projected HF Methods: A Comparison Based on the Stability
Properties of the Closed-Shell RHF Solutions for Large Cyclic
Polyenes, Chem. Phys. Lett. 130 (1986) 123-126.

- P. Karadakov and O. Castaño, Instability of the
Closed-Shell Hartree-Fock Solutions in the Framework of the
Geminal Approach, Teor. Eksp. Khim. 22 (1986)
394-400 (in Russian).

- P. Karadakov, El metodo Hartree-Fock semi-proyectado:
Esquemas de optimizacion directa y condiciones de
estabilidad, Fol. Chim. Theor. Lat. 14 (1986) 11-37 (in
Spanish).

- P. Karadakov and O. Castaño, A Note on Time-Dependent
Variational Principles, Chem. Phys. Lett. 140 (1987)
367-369.

- P. Karadakov, O Castaño and J.-L. Calais, A Simplified
Antisymmetrized Product of Geminals Wavefunction for Extended
Systems. I. Delocalized Geminals, J. Chem. Phys. 92
(1990) 3021-3026.

- P. Karadakov, O. Castaño and J.-L. Calais, A Simplified
Antisymmetrized Product of Geminals Wavefunction for Extended
Systems. II. Localized Geminals, J. Chem. Phys. 92 (1990)
3027-3033.

- P. Karadakov, O. Castaño and J.-L. Calais,
Una funcion de onda mejorada del tipo de geminales de Fock
para el caso de systemas con estructra periodica. Un analisis
critico, Fol. Chim. Theor. Lat. 18 (1990) 27-39 (in
Spanish).

- P. Karadakov and O. Castaño, Hamiltonian and Overlap Matrix
Elements between Half-Projected DODS Slater Determinants,
Teor. Eksp. Khim. 26 (1990) 525-536 (in Russian).

- O. Castaño and P. Karadakov, Comments on the paper "On
different types of states in a unidimensional system of
electrons using the unrestricted Hartree-Fock method" by
A. E. Belinsky, A. I. Chugreev and I. A. Misurkin,
Teor. Eksp. Khim. 27 (1991) 517 (in Russian).

- P. Karadakov, J.-L. Calais and J. Delhalle, A
Localized-Basis Monoexcited Configuration Interaction
Technique for Extended Systems, J. Chem. Phys. 94 (1991)
8520-8528.

- E. C. Gravett, J. A. K. Howard, K. Mackenzie, L. Shi-Xiong,
and P. B. Karadakov, The Unusual Reaction of
Tetrachlorothiophene Dioxide with an Adduct of
5,6-Bismethylenenorbornene and Hexachloronorbornadiene,
J. Chem. Soc. Chem. Commun. (1991) 1763-1765.

- P. B. Karadakov, J. Gerratt, D. L. Cooper and M. Raimondi,
Core-Valence Separation in the Spin-Coupled Wavefunction:
A Fully Variational Treatment Based on a Second-Order
Constrained Optimization Procedure, J. Chem. Phys. 97
(1992) 7637-7655.

- P. B. Karadakov, J. Gerratt, D. L. Cooper and M. Raimondi,
Bent versus s-p Bonds in Ethene and Ethyne:
The Spin-Coupled Point of View, J. Am. Chem. Soc. 115
(1993) 6863-6869.

- P. B. Karadakov, J. Gerratt, G. Raos, D. L. Cooper
and M. Raimondi,
The Lowest Singlet and Triplet States of
o -Benzyne: Spin-Coupled Interpretation of the Electronic
Structure at CAS SCF Equilibrium Geometries,
Isr. J. Chem. 33 (1993) 253-264.

- E. C. Gravett, J. A. K. Howard, K. Mackenzie,
L. Shi-Xiong,
and P. B. Karadakov, Sequential
Cycloaddition-Cycloreversion-Cycloaddition-Cope
Rearrangement with an Annelated Norbornadiene and
Electrophilic Dienes. Unusual [p2s + p2a + s2a] Transformation of a
Pentacyclo-[11.4.0.1 7,10.0 4,13.0 6,11] octadeca-3,8,14,17-tetraene,
Tetrahedron 49 (1993) 4699-4710.

- P. B. Karadakov, J. Gerratt, G. Raos, D. L. Cooper
and M. Raimondi,
Spin-Coupled Study of the Electronic Structure of
Polyenyl Radicals: C3H5-C9H11,
J. Am. Chem. Soc. 116 (1994) 2075-2084.

- P. B. Karadakov, J. Gerratt, D. L. Cooper and
M. Raimondi,
Spin-Coupled Description of Organic Reaction Pathways:
The Cycloaddition Reaction of Two Ethene Molecules,
J. Chem. Soc. Faraday Trans. 90 (1994) 1643-1651.

- D. L. Cooper, T. P. Cunningham, J. Gerratt,
P. B. Karadakov and M. Raimondi,
Chemical Bonding to Hypercoordinate Second-Row Atoms:
d Orbital Participation Versus Democracy,
J. Am. Chem. Soc. 116 (1994) 4414-4426.

- P. B. Karadakov, J. Gerratt, D. L. Cooper and M. Raimondi,
The Nature of the Carbon-Carbon Bonds in Cyclopropane and
Cyclobutane: A Comparison Based on Spin-Coupled Theory,
J. Am. Chem. Soc. 116 (1994) 7714-7721.

- P. B. Karadakov, J. Gerratt, D. L. Cooper and M. Raimondi,
SPINS: A Program for Symbolic Generation and Transformation of
Spin Eigenfunctions,
Theor. Chim. Acta 90 (1995) 51-73.

- P. C. H. Mitchell, G. Raos, P. B. Karadakov,
J. Gerratt and D. L. Cooper,
Catalytic Chemistry of Furan and Thiophene. Ab Initio
Calculations using the Spin-Coupled Valence Bond Method of
the Interaction between Furan and Thiophene and a
Positively-Charged Centre, J. Chem. Soc. Faraday
Trans. 91 (1995) 749-758.

- P. B. Karadakov, J. Gerratt, D. L. Cooper and M. Raimondi,
Modern Valence-Bond Description of Bonding in Strained
Three-Membered Rings: Cyclopropane, Aziridine, Ethylene Oxide,
Phosphirane and Thiirane,
J. Mol. Struc. THEOCHEM 341 (1995) 13-24.

- P. B. Karadakov, J. Gerratt, D. L. Cooper and M. Raimondi,
The Electronic Structure of Cyclooctatetraene and the Modern
Valence-Bond Understanding of Antiaromaticity,
J. Phys. Chem. 99 (1995) 10186-10195.

- D. R. Alleres, D. L. Cooper, T. P. Cunningham,
J. Gerratt, P. B. Karadakov and M. Raimondi, On the
Bonding in YXXY Dihalides and Dihydrates of Dioxygen and
Disulfur, J. Chem. Soc. Faraday Trans. 91 (1995)
3357-3362.

- D. L. Cooper, J. Gerratt, P. B. Karadakov and
M. Raimondi, Modern Valence Bond Description of
(CH3)4Li4,
J. Chem. Soc. Faraday Trans. 91 (1995) 3363-3365.

- B. Petch, D. L. Cooper, J. Gerratt, P. B. Karadakov and
M. Raimondi, Modern Valence Bond Description of the
Ground State of Li2-, J. Chem. Soc. Faraday
Trans. 91 (1995) 3751-3754.

- G. Raos, J. Gerratt, P. B. Karadakov, D. L. Cooper
and M. Raimondi,
Aromatic Electrophilic Substitution: A Modern Valence
Bond Study, J. Chem. Soc. Faraday Trans. 91 (1995)
4011-4030.

- T. Thorsteinsson, D. L. Cooper, J. Gerratt,
P. B. Karadakov and M. Raimondi, Modern Valence Bond
Representations of CAS SCF Wavefunctions,
Theor. Chim. Acta 93 (1996) 343-366.

- S. J. McNicholas, J. Gerratt, P. B. Karadakov,
M. Sironi, M. Raimondi and D. L. Cooper, The
Extraordinary Electronic Structure of S2N2,
J. Am. Chem. Soc. 118 (1996) 6472-6476.

- T. P. Cunningham, D. L. Cooper, J. Gerratt,
P. B. Karadakov and M. Raimondi,
Chemical Bonding in Oxohalides of Hypercoordinate
Nitrogen and Phosphorus,
Int. J. Quantum Chem. 60 (1996) 393-400.

- P. B. Karadakov, J. Gerratt, D. L. Cooper,
M. Raimondi and M. Sironi, Modern Valence-Bond
Description of the Electronic Structure of
Benzocyclobutadiene, Int. J. Quantum Chem. 60
(1996) 545-552.

- J. M. Oliva, J. Gerratt, D. L. Cooper,
P. B. Karadakov and M. Raimondi, Study of the
Electronic States of the Allyl Radical using Spin-Coupled
Valence Bond Theory, J. Chem. Phys. 106 (1997)
3663-3672.

- P. B. Karadakov, M. Ellis, J. Gerratt, D. L. Cooper
and M. Raimondi, The Electronic Structure of
Borabenzene: Combination of an Aromatic p-Sextet and a
Reactive s-Framework, Int. J. Quantum
Chem. 63 (1997) 441-449.

- G. Raos, L. Astorri, M. Raimondi, D. L. Cooper,
J. Gerratt and P. B. Karadakov, Spin-Coupled Valence
Bond Study of the Reaction between Benzene and a Methyl
Cation, J. Phys. Chem. A101 (1997) 2886-2892.

- J. Gerratt, D. L. Cooper, P. B. Karadakov and
M. Raimondi, Modern Valence Bond Theory,
Chem. Soc. Rev. 26 (1997) 87-100.

- T. P. Cunningham, D. L. Cooper, J. Gerratt,
P. B. Karadakov and M. Raimondi, Chemical Bonding in
Oxofluorides of Hypercoordinate Sulfur,
J. Chem. Soc. Faraday Trans. 93 (1997) 2247-2254.

- J. Gerratt, D. L. Cooper, P. B. Karadakov and
M. Raimondi, Spin-Coupled Theory, in
The Encyclopedia of Computational Chemistry,
Ed. P. v. R. Schleyer, Wiley, 1998, 2672-2688.

- G. Raos, S J. McNicholas, J. Gerratt, D. L. Cooper and
P. B. Karadakov, Antiferromagnetic Spin Couplings in
Cyclobutadiene Chains,
J. Phys. Chem. 101 (1997) 6688-6691.

- J. M. Oliva, J. Gerratt, P. B. Karadakov
and D. L. Cooper, Conrotatory and
Disrotatory Pathways in the Electrocyclic Isomerization of
Cyclobutene to cis-Butadiene: The Spin-Coupled Viewpoint,
J. Chem. Phys. 107 (1997) 8917-8826.

- P. B. Karadakov, D. L. Cooper and J. Gerratt,
Modern Valence-Bond Description of Chemical Reaction
Mechanisms: Diels-Alder Reaction,
J. Am. Chem. Soc. 120 (1998) 3975-3981.

- M. Raimondi, M. Sironi, J. Gerratt, D. L. Cooper and
P. B. Karadakov, Spin-Coupled Description of
Fluorocyclophosphazenes: (NPF2)3, (NPF2)4,
(NPF2)5,
J. Chem. Soc. Faraday Trans. 94 (1998) 1541-1546.

- P. B. Karadakov,
New Trends in Ab Initio Valence Bond Theory,
Ann. Rep. Prog. Chem., Sect. C 94 (1998) 3-48.

- P. B. Karadakov, D. L. Cooper and J. Gerratt,
Modern Valence-Bond Description of Chemical Reaction
Mechanisms: The 1,3-Dipolar Addition of Fulminic
Acid to Ethyne, Theor. Chem. Acc. 100 (1998)
222-229.

- B. Friis-Jensen, D. L. Cooper, S. Rettrup, and
P. B. Karadakov, Spin-Coupled Calculations on
Phenylenedimethylidene,
J. Chem. Soc. Faraday Trans. 94 (1998) 3301-3306.

- P. B. Karadakov, G. A. Webb and J. A. England,
The Effect of Electron Correlation on the
19F Chemical Shifts in Fluorobenzenes,
ACS Symp. Series 732 (1999) 115-125.

- F. Ogliaro, D. L. Cooper, and P. B. Karadakov,
Bent Bond vs Separated Bond Models:
A Spin-Coupled Survey for a few Organic and Inorganic
Systems, Int. J. Quantum Chem., 74 (1999) 223-229.

- P. B. Karadakov and K. Morokuma,
ONIOM as an Efficient Tool for Calculating NMR Chemical
Shielding Constants in Large Molecules,
Chem. Phys. Lett. 317 (2000) 589-596.

- P. B. Karadakov, D. L. Cooper, T. Thorsteinsson
and J. Gerratt,
Modern Valence-Bond Description of the Mechanisms
of Six-Electron Pericyclic Reactions,
in Quantum Systems in Chemistry and Physics. Volume 1:
Basic Problems and Models Systems, ed. A. Hernández-Laguna,
J. Maruani, R. McWeeny and S. Wilson (Kluwer, Dordrecht, 2000)
327-344.

- G. A. Webb, P. B. Karadakov and J. A. England,
Electron Correlation Effects on Geometries and
19F Chemical Shifts in Fluorobenzenes,
Bull. Pol. Ac. Sci. Chem. 48 (2000) 101-112.
 
- F. Ogliaro, S. D. Loades, D. L. Cooper and
P. B. Karadakov, Spin-Coupled Model of the Bonding
in First-Row Transition Metal Methylene Monocations,
J. Phys. Chem. A 104 (2000) 7091-7098.

- J. J. Blavins, P. B. Karadakov and D. L. Cooper,
Modern Valence-Bond Description of Chemical Reaction
Mechanisms: The 1,3-Dipolar Addition of
Diazomethane to Ethene,
J. Org. Chem. 66 (2001) 4285-4292.

- A. Famulari, G. Calderoni, F. Moroni, M. Raimondi and
P. B. Karadakov,
Application of the DIIS Technique to Improve the Convergence
Properties of the SCF-MI Algorithm,
J. Mol. Struc. 549 (2001) 95-99.

- D. L. Cooper, N. L. Alan and P. B. Karadakov,
Confronting Modern Valence Bond Theory with
Momentum-Space Quantum Similarity and with Pair Density
Analysis, in The Fundamentals of Molecular
Similarity, ed. R. Carbó-Dorca (Kluwer, Dordrecht,
2001) 169-180.

- P. B. Karadakov,
Theoretical Description of Reaction Mechanisms:
Reaction Pathways and Electronic Structure Rearrangements,
Ann. Rep. Prog. Chem., Sect. C 97 (2001) 61-90.

- P.B. Karadakov and D.L. Cooper, Reply to Comment "Electronic
Reorganization in 1,3-Dipolar Cycloaddition of Fulminic Acid to
Acetylene", J. Phys. Chem. A 105 (2001) 10946.

- F. Ogliaro, S. D. Loades, D. L. Cooper, and
P. B. Karadakov,
Symmetry-separated (s+p) vs Bent-Bond
(W) Models of First-Row Transition Metal Methylene
Cations, in New Trends in Quantum Systems in Chemistry
and Physics 1 (Kluwer, Dordrecht, 2001) 281-311.

- P. B. Karadakov,
Electron Correlation and Basis Set Effects on the 17O
and 1H Nuclear Magnetic Shieldings in Water Clusters
(H2O)n (n = 2-5),
J. Mol. Struc. 602-603 (2002) 293-301.

- D. L. Cooper, P. B. Karadakov and T. Thorsteinsson,
Modern Valence Bond Description of Gas-Phase Pericyclic
Reactions, in Valence Bond Theory, ed. D. L. Cooper
(Elsevier, Amsterdam, 2002) 41-53.

- P. Avalle, R. K. Harris, P. B. Karadakov and
P. J. Wilson,
Calculations of Magnetic Shielding for the Tin Nucleus in
a Series of Tetra-organotin Compounds using Density Functional
Theory, Phys. Chem. Chem. Phys. 4 (2002) 5925-5932.

- P. B. Karadakov,
Spin Functions,
in Handbook of Molecular Physics and Quantum Chemistry,
ed. S. Wilson, R. McWeeny, P. Bernath and V. Ortiz (Wiley,
Chichester, 2003) Volume 2, Part 1, Chapter 3, 25-32.

- P. B. Karadakov,
Spatial Wavefunctions,
in Handbook of Molecular Physics and Quantum Chemistry,
ed. S. Wilson, R. McWeeny, P. Bernath and V. Ortiz (Wiley,
Chichester, 2003) Volume 2, Part 1, Chapter 4, 33-40.

- J. Gerratt, D. L. Cooper, P. B. Karadakov and
M. Raimondi, Spin-Coupled Theory,
in Handbook of Molecular Physics and Quantum Chemistry,
ed. S. Wilson, R. McWeeny, P. Bernath and V. Ortiz (Wiley,
Chichester, 2003), Volume 2, Part 2, Chapter 12, 148-168.

- G. A. Rickard, P. B. Karadakov, G. A. Webb and
K. Morokuma,
Calculation of NMR Chemical Shifts in Carbohydrates with ONIOM:
A Study of the Conformers of b-D-Glucopyranose,
J. Phys. Chem. A 107 (2003) 292-300.

- J. J. Blavins, P. B. Karadakov and D. L. Cooper,
Modern Valence-Bond Description of Chemical Reaction
Mechanisms: The 1,3-Dipolar Addition of
Methyl Azide to Ethene,
J. Phys. Chem. A 107 (2003) 2548-2559.

- J. J. Blavins, D. L. Cooper and P. B. Karadakov,
Aromatic versus Diradical Character in the Transition States
of the Cope Rearrangements of 1,5-Hexadiene and its Cyano
Derivatives, J. Phys. Chem. A 108 (2004) 194-202.

- J. J. Blavins, D. L. Cooper and P. B. Karadakov,
Modern Valence Bond Description of the Electronic
Mechanisms of SN2 Identity Reactions, J. Phys. Chem. A
108 (2004) 914-920.

- J. J. Blavins, D. L. Cooper and P. B. Karadakov,
Spin-Coupled Study of Addition Reactions of Singlet
Dihalocarbenes with Ethene,
Int. J. Quantum Chem. 98 (2004) 465-472.

- J. J. Blavins, D. L. Cooper and P. B. Karadakov,
Spin-Coupled Study of the Electronic Mechanism of the
Hetero-Diels-Alder Reaction of Acrolein and Ethene,
J. Phys. Chem. 109 (2005) 231-235.

- J. G. Hill, P. B. Karadakov and D. L. Cooper,
A Spin-Coupled Study of the Claisen Rearrangement of
Allyl Vinyl Ether, Theor. Chem. Acc., 115 (2005) 212-220.

- J. G. Hill, P. B. Karadakov and D. L. Cooper,
The Spin-Coupled Picture of Clamped Benzenes,
Mol. Phys., 104 (2006) 677-680.

- J. G. Hill, D. L. Cooper and P. B. Karadakov,
Modern VB-like Representations of Selected D6h
'Aromatic' Rings,
J. Phys. Chem. A 110 (2006) 7913-7917.

- P. B. Karadakov,
Ab Initio Calculation of NMR Shielding Constants,
in Modern Magnetic Resonance. Part 1: Applications in
Chemistry, Biological and Marine Sciences, ed. G. Webb
(Springer, Berlin, 2007), 59-66.

- P. B. Karadakov, J. G. Hill and D. L. Cooper,
The Unusual Electronic Mechanism of the [1s,
5s] Hydrogen Shift in (Z)-1,3-Pentadiene
Predicted by Modern Valence Bond Theory,
Faraday Discuss. 135 (2007) 285-297.

- G. A. Richings and P. B. Karadakov,
A Variationally Stable Compact Hartree-Fock-Style
Wavefunction for a Non-Degenerate First Excited State,
Mol. Phys. 105 (2007) 2363-2373.

- V. N. Kozhevnikov, S. Cowling, P. B. Karadakov
and D. W. Bruce,
Mesomorphic 1,2,4-triazine-4-oxides in the Synthesis of New
Heterocyclic Liquid Crystals,
J. Mater. Chem. 28 (2008) 1703-1710.

- P. B. Karadakov,
Advances in Valence Bond Theory,
in A Specialist Periodical Report: Chemical Modelling,
Applications and Theory. Volume 5,
ed. A. Hinchliffe (RSC, Cambridge, 2008), 312-349.

- P. B. Karadakov,
Ground and Excited State Aromaticity and Antiaromaticity in
Benzene and Cyclobutadiene,
J. Phys. Chem. A 112 (2008) 7303–-7309.

- P. B. Karadakov,
Aromaticity and Antiaromaticity in the Low-Lying Electronic
States of Cyclooctatetraene,
J. Phys. Chem. A 112 (2008) 12707-12713.

- J. G. Hill, D. L. Cooper and P. B. Karadakov,
The Spin-Coupled Description of Aromaticity in the
Retro Diels-Alder Reaction of Norbornene,
J. Phys. Chem. A 112 (2008) 12823-12828.

- P. B. Karadakov, D. L. Cooper and A. Uhe,
Modern Valence Bond Description of the Electronic Mechanism
of a [1,3] Sigmatropic Rearrangement Linking
Bicyclo[3.2.0]hept-2-ene and Bicyclo[2.2.1]hept-2-ene
(Norbornene),
Int. J. Quantum Chem. 109 (2009) 1807-1811.

- P. B. Karadakov and D. L. Cooper,
Comparison between the Performances of the Spin-Projected
Hartree-Fock, Generalized Valence-Bond and
Spin-Coupled Approaches,
Int. J. Quantum Chem. 109 (2009) 2447-2455.

- D. L. Cooper and P. B. Karadakov,
Spin-Coupled Descriptions of Organic Reactivity,
Int. Rev. Phys. Chem. 28 (2009) 169-206.
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| Computing |
- P. Karadakov, Hidden Lines in a Disk Directory, Komputer za Vas, 3 (1986) 33-34 (in Bulgarian).

- P. Karadakov, HGR Sector Inversion, Komputer za Vas, 4 (1987) 25-29 (in Bulgarian).

- P. Karadakov, DelDir: Fast Deletion of Directories with their Contents, Komputer za Vas, 7-8 (1989) 47-48 (in Bulgarian).

- P. Karadakov and J. Jordanov, Multi-Edit (A Multi-Function Program Editor), Komputer za Vas, 3-4 (1990) 17-18 (in Bulgarian).

- P. Karadakov and J. Jordanov, Fortran Converter (A Program Macro for Multi-Edit), Komputer za Vas, 9-10 (1989) 37-38 (in Bulgarian).

- P. B. Karadakov, Benchmarking Titan, Broadcast (Univ. of Surrey Comp. Services Newsletter) 15 (1997) 11.
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