Semiempirical calculation of the electronic structure of complexes of the nitrogen molecule with Li+ and F? ions

S. G. Gagarin; I. A. Lygina

doi:10.1007/bf00747556

Semiempirical calculation of the electronic structure of complexes of the nitrogen molecule with Li+ and F? ions

Journal of Structural Chemistry ◽

10.1007/bf00747556 ◽

1975 ◽

Vol 16 (1) ◽

pp. 96-100 ◽

Cited By ~ 1

Author(s):

S. G. Gagarin ◽

I. A. Lygina

Keyword(s):

Electronic Structure ◽

Nitrogen Molecule ◽

Semiempirical Calculation

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Semiempirical Calculation on the Electronic Structure of the Nitrogen‐Containing Heterocyclic Molecules. IV. Electronic Structure of Pyridine

The Journal of Chemical Physics ◽

10.1063/1.1730809 ◽

1960 ◽

Vol 32 (3) ◽

pp. 867-871 ◽

Cited By ~ 10

Author(s):

Tosinobu Anno

Keyword(s):

Electronic Structure ◽

Semiempirical Calculation ◽

Heterocyclic Molecules

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Semiempirical Calculation on the Electronic Structure of the Nitrogen‐Containing Heterocyclic Molecules. II. Electronic Structure of Pyrazine with Particular Reference to Its n—π Transition

The Journal of Chemical Physics ◽

10.1063/1.1744672 ◽

1958 ◽

Vol 29 (5) ◽

pp. 1170-1173 ◽

Cited By ~ 20

Author(s):

Tosinobu Anno ◽

Akira Sadô

Keyword(s):

Electronic Structure ◽

Semiempirical Calculation ◽

Heterocyclic Molecules

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Calculation of the electronic structure of complexes of 3d-transition metals with a nitrogen molecule

Theoretical and Experimental Chemistry ◽

10.1007/bf00530563 ◽

1973 ◽

Vol 6 (6) ◽

pp. 594-600

Author(s):

K. B. Yatsimirskii ◽

Yu. P. Nazarenko ◽

Yu. I. Bratushko ◽

Yu. A. Kruglyak

Keyword(s):

Electronic Structure ◽

Transition Metals ◽

Nitrogen Molecule

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Semiempirical Calculation on the Electronic Structure of the Nitrogen‐Containing Heterocyclic Molecules. I. General Theory

The Journal of Chemical Physics ◽

10.1063/1.1744671 ◽

1958 ◽

Vol 29 (5) ◽

pp. 1161-1169 ◽

Cited By ~ 36

Author(s):

Tosinobu Anno

Keyword(s):

Electronic Structure ◽

General Theory ◽

Semiempirical Calculation ◽

Heterocyclic Molecules

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On the accuracy of the algebraic approximation in molecular electronic structure calculations: V. Electron correlation in the ground state of the nitrogen molecule

Journal of Physics B Atomic Molecular and Optical Physics ◽

10.1088/0953-4075/29/12/009 ◽

1996 ◽

Vol 29 (12) ◽

pp. 2425-2451 ◽

Cited By ~ 32

Author(s):

D Moncrieff ◽

S Wilson

Keyword(s):

Electronic Structure ◽

Electron Correlation ◽

Ground State ◽

Electronic Structure Calculations ◽

Nitrogen Molecule ◽

Molecular Electronic ◽

Algebraic Approximation ◽

Molecular Electronic Structure ◽

Structure Calculations

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A semiempirical calculation of electronic structure of multiple CdS-based clusters

Czechoslovak Journal of Physics ◽

10.1007/bf01692003 ◽

1995 ◽

Vol 45 (12) ◽

pp. 1115-1123

Author(s):

V. S. Gurin

Keyword(s):

Electronic Structure ◽

Semiempirical Calculation

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Semiempirical Calculation on the Electronic Structure of the Nitrogen‐Containing Heterocyclic Molecules. III. Lower Triplet Levels of Pyrazine

The Journal of Chemical Physics ◽

10.1063/1.1730754 ◽

1960 ◽

Vol 32 (2) ◽

pp. 619-620 ◽

Cited By ~ 8

Author(s):

Tosinobu Anno ◽

Akira Sadô

Keyword(s):

Electronic Structure ◽

Semiempirical Calculation ◽

Heterocyclic Molecules

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Semiempirical calculation of the electronic structure of 12-crown-4 and 12-thio-crown-4

Theoretical and Experimental Chemistry ◽

10.1007/bf00520981 ◽

1980 ◽

Vol 15 (6) ◽

pp. 559-562

Author(s):

V. B. Volkov ◽

K. B. Yatsimirskii

Keyword(s):

Electronic Structure ◽

Semiempirical Calculation

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Semiempirical calculation of the energy characteristics and electronic structure of a spherand and its complexes with metals

Theoretical and Experimental Chemistry ◽

10.1007/bf00568925 ◽

1985 ◽

Vol 20 (6) ◽

pp. 679-681

Author(s):

E. D. Lavrinenko-Ometsinskaya ◽

V. B. Volkov

Keyword(s):

Electronic Structure ◽

Semiempirical Calculation ◽

Energy Characteristics

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On the accuracy of the algebraic approximation in molecular electronic structure calculations. III. Comparison of matrix Hartree-Fock and numerical Hartree-Fock calculations for the ground state of the nitrogen molecule

Journal of Physics B Atomic Molecular and Optical Physics ◽

10.1088/0953-4075/26/10/003 ◽

1993 ◽

Vol 26 (10) ◽

pp. 1605-1616 ◽

Cited By ~ 55

Author(s):

D Moncrieff ◽

S Wilson

Keyword(s):

Electronic Structure ◽

Ground State ◽

Electronic Structure Calculations ◽

Nitrogen Molecule ◽

Molecular Electronic ◽

Hartree Fock ◽

Algebraic Approximation ◽

Molecular Electronic Structure ◽

Structure Calculations

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