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Ab initio characterization of the low-lying vibrations of HCO (DCO) in the B ̃ 2 A ′ state

The Journal of chemical physics, 1995-11, Vol.103 (18), p.7664-7672

1995

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An ab Initio Study of the Structures of Cyclic N 4 O 2

Journal of physical chemistry (1952), 1996-01, Vol.100 (2), p.611-615

1996

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An ab Initio Study of the Structures of Cyclic N4O2

Journal of physical chemistry (1952), 1996-01, Vol.100 (2), p.611-615

1996

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Avoided surface crossings and nonadiabatic effects in the electronic quenching reaction Li(2P) + HCl → LiCl + H(2S)

Journal of physical chemistry (1952), 1993-05, Vol.97 (19), p.4989-4995

1993

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Avoided surface crossings and nonadiabatic effects in the electronic quenching reaction lithium(2P) + hydrogen chloride .fwdarw. lithium chloride + hydrogen atom(2S)

Journal of physical chemistry (1952), 1993-05, Vol.97 (19), p.4989-4995

1993

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C 48N 12 and C 48B 12 as a donor–acceptor pair for molecular electronics

Chemical physics letters, 2003, Vol.382 (1), p.194-197

Riad Manaa, M.

2003

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C48N12 and C48B12 as a donor-acceptor pair for molecular electronics

Chemical physics letters, 2003-11, Vol.382 (1-2), p.194-197

MANAA, M. Riad

2003

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Chapter 10 - A Multi-Scale Approach to Molecular Dynamics Simulations of Shock Waves

Chemistry at Extreme Conditions, 2005, p.297-326

2005

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Chapter 17 - Chemistry of Detonation Waves in Condensed Phase Explosives

Chemistry at Extreme Conditions, 2005, p.495-516

2005

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Chemistry at Extreme Conditions

1, 2005

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Chemistry of Detonation Waves in Condensed Phase Explosives

Chemistry at Extreme Conditions, 2005

Manaa, M. R

2005

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Chemistry of Detonation Waves in Condensed Phase Explosives

ChemInform, 2006-06, Vol.37 (23), p.no-no

2006

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A comparative study of cubic B4N4 and C8

Journal of molecular structure. Theochem, 2001-08, Vol.549 (1-2), p.23-26

Manaa, M.Riad

2001

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Decomposition of HMX at Extreme Conditions: A Molecular Dynamics Simulation

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2002-10, Vol.106 (39), p.9024-9029

2002

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Design and synthesis of energetic materials

Annual review of materials research, 2001-01, Vol.31 (1), p.291-321

2001

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DESIGN AND SYNTHESIS OF ENERGETIC MATERIALS 1

Annual review of materials research, 2001-08, Vol.31 (1), p.291-321

2001

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Determination of adiabatic ionization potentials and electron affinities of energetic molecules with the Gaussian-4 method

Chemical physics letters, 2017-06, Vol.678 (C), p.102-106

Manaa, M. Riad

2017

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Determination of enthalpies of formation of energetic molecules with composite quantum chemical methods

Chemical physics letters, 2016-03, Vol.648 (C), p.31-35

2016

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DFT and ab Initio Study of the Unimolecular Decomposition of the Lowest Singlet and Triplet States of Nitromethane

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 1998-11, Vol.102 (48), p.9884-9889

1998

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Early chemistry in hot and dense nitromethane: molecular dynamics simulations

The Journal of chemical physics, 2004-06, Vol.120 (21), p.10146-10153

2004

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Electronic structure of solid nitromethane: Effects of high pressure and molecular vacancies

The Journal of chemical physics, 2002-07, Vol.117 (2), p.788-799

2002

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Enhanced energetic stability and optical activity of symmetry-reduced C 60

Chemical physics letters, 2006-06, Vol.424 (1), p.139-141

Manaa, M. Riad

2006

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Enhanced energetic stability and optical activity of symmetry-reduced C60

Chemical physics letters, 2006-06, Vol.424 (1-3), p.139-141

Manaa, M. Riad

2006

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Excitations, optical absorption spectra, and optical excitonic gaps of heterofullerenes. I. C60, C59N+, and C48N12: theory and experiment

The Journal of chemical physics, 2004-03, Vol.120 (11), p.5133-5147

2004

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Explosive chemistry: Simulating the chemistry of energetic materials at extreme conditions

Journal of computer-aided materials design, 2003, Vol.10 (2), p.75-97

2003

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Ab initio characterization of the low-lying vibrations of HCO (DCO) in the B ̃ 2 A ′ state

An ab Initio Study of the Structures of Cyclic N 4 O 2

An ab Initio Study of the Structures of Cyclic N4O2

Avoided surface crossings and nonadiabatic effects in the electronic quenching reaction Li(2P) + HCl → LiCl + H(2S)

Avoided surface crossings and nonadiabatic effects in the electronic quenching reaction lithium(2P) + hydrogen chloride .fwdarw. lithium chloride + hydrogen atom(2S)

C 48N 12 and C 48B 12 as a donor–acceptor pair for molecular electronics

C48N12 and C48B12 as a donor-acceptor pair for molecular electronics

Chapter 10 - A Multi-Scale Approach to Molecular Dynamics Simulations of Shock Waves

Chapter 17 - Chemistry of Detonation Waves in Condensed Phase Explosives

Chemistry at Extreme Conditions

Chemistry of Detonation Waves in Condensed Phase Explosives

Chemistry of Detonation Waves in Condensed Phase Explosives

A comparative study of cubic B4N4 and C8

Decomposition of HMX at Extreme Conditions: A Molecular Dynamics Simulation

Design and synthesis of energetic materials

DESIGN AND SYNTHESIS OF ENERGETIC MATERIALS 1

Determination of adiabatic ionization potentials and electron affinities of energetic molecules with the Gaussian-4 method

Determination of enthalpies of formation of energetic molecules with composite quantum chemical methods

DFT and ab Initio Study of the Unimolecular Decomposition of the Lowest Singlet and Triplet States of Nitromethane

Early chemistry in hot and dense nitromethane: molecular dynamics simulations

Electronic structure of solid nitromethane: Effects of high pressure and molecular vacancies

Enhanced energetic stability and optical activity of symmetry-reduced C 60

Enhanced energetic stability and optical activity of symmetry-reduced C60

Excitations, optical absorption spectra, and optical excitonic gaps of heterofullerenes. I. C60, C59N+, and C48N12: theory and experiment

Explosive chemistry: Simulating the chemistry of energetic materials at extreme conditions

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