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List of Publications-July 2017

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162

J. Z. A. Laloo, N. Laloo, L. Rhyman, P. Ramasami “ExcelAutomat: A Tool for Systematic Processing of Files as Applied to Quantum Chemical Calculations” (Journal of Computer-Aided Molecular Design, 2017, In Press)

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161

C. Parlak, Ö. Alver, P. Ramasami “Adsorption Mechanisms of 6-Chloro-3-Hydroxy-2-Pyrazinecarboxamide on Pristine, Si- and Al-Doped C60 Fullerenes: A DFT Study” (Journal of Cluster Science, 2017, In Press)

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160


D. Hallooman, H. Bhakhoa, M. Ríos-Gutiérrez, L. Rhyman, A. A. Oliferenko, A. R. Katritzky, I. A. Alswaidan, M. I. Elzagheid, L, R. Domingo, P. Ramasami “Copper(I)-catalysed Regioselective Synthesis of Pyrazolo[5,1-c]-1,2,4-triazoles: A DFT Mechanistic Study” (Tetrahedron, In Press)

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159

V. Uahengo, Y. Zhang, Bi Xiong, P. Zhao, P. Cai, L. Rhyman, P. Ramasami, K. Hu, G. Cheng “A Fluoro-Chromogenic Sensor Based on Organic Molecular Framework for Cu2+ and F in Aqueous Soluble DMSO” (Journal of Fluorescence, 2017, 29, 191-197)

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158

M. M. Jadhav, I. A Alswaidan, L. Rhyman, P. Ramasami and N. Sekar “TD-DFT Investigation of 2, 5-Bis(2-benzothiazolyl) hydroquinone and 2, 5-Bis(benzo[d] thiazol-2-yl)-4-methoxyphenol” (Journal of Solution Chemistry, 2017, 46, 1005-1023)

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157

N. Toorabally, L. Rhyman, I. A Alswaidan, C. Parlak, M. I. Elzagheid, V. Uahengo, R. Somanah and P. Ramasami “Structural and spectroscopic parameters of CnF2+ (n= 1-5): Insights using MP2/CBS method” (Journal of Fluorine Chemistry, 2017, In Press).

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156

C. Parlak, G. Keşan, N. Kazancı, L. Rhyman, P. Ramasami, Ö. Alver and S. Akgöl “Conformational and Electronic Properties of N-Methacryloyl-(L)-glutamic acid” (Physics and Chemistry of Liquids, 2017, 55, 532-540)

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155

T. C. S. Shetty, C. S. C. Kumar, K.N. G. Patel, T. S. Chia, S.M. Dharmaprakash, P Ramasami, Y. Umar and S. Chandraju “Optical Nonlinearity of D-A-π-D and D-A-π-A Type of New Chalcones for Potential Applications in Optical Limiting and Density Functional Theory Studies” (Journal of Molecular Structure, 2017, 1143, 306-317)

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154

M. J. Mphahlele, M. M. Maluleka, L. Rhyman, P. Ramasami and R. M. Mampa “Spectroscopic, DFT, and XRD Studies of Hydrogen Bonds in N-Unsubstituted 2-Aminobenzamides” (Molecules, 2017, 22, 83)

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153

F. Anum, A. Abbas, K. Mun Lo, S. Hameed, P. Ramasami, Y. Umar and M. M. Naseer “Synthesis, Solid state self-assembly, Experimental and Theoretical Investigations of a Chalcone Derivative” (Spectrochimica Acta A, Submitted, 2016)

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152

S. Katariya, L. Rhyman, I. A. Alswaidan, P. Ramasami and N. Sekar, “Triphenylamine-Based Fluorescent Styryl Dyes: DFT, TD-DFT and Non-Linear Optical Property Study” (Journal of Fluorescence, 2017, 27, 993-1007)

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151

S. Kuchekar, S. Pulate, V. Gaikwad, P. Dighe and P. Ramasami “Solvent Extraction, Spectrophotometric Determination Of Selenium (Iv) At Microgram Level Using O-Methylphenyl Thiourea As A Sensitive Reagent: Analysis Of Pharmaceuticals, Synthetic Mixtures And Real Samples” (World Journal of Pharmacy and Phamaceutical Science, 2017, 6, 1664-1685).

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150

I. A. Alswaidan, K. Sooknah, L. Rhyman, C. Parlak, D. T. Ndinteh, M. I. Elzagheid and P. Ramasami “2,4-Ditellurouracil and its 5-fluoro derivative: Theoretical investigations of structural, energetics and ADME parameters” (Computational Biology and Chemistry, 2017, 68, 56-63)

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149

L. N. Obasi, U. S. Oruma, I. A. Al-Swaidan, P. Ramasami, C. J. Ezeorah and A. E. Ochonogor “Synthesis, Characterization and Antibacterial Studies of N-(Benzothiazol-2-yl)-4-chlorobenzenesulphonamide and Its Neodymium (III) and Thallium (III) Complexes” (Molecules, 2017, 22, 153)

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148

C. Parlak, Ö. Alver, P. Ramasami “Interaction Mechanisms and Structural Properties of B-, Si-doped C60 Fullerenes with 1-Formylpiperazine” (Main Group Metal Chemistry, 2016, 39, 145-150)

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147

A. Sid, A. Messai, C. Parlak, N. Kazancı, D. Luneau, G. Keşan, L. Rhyman, I. A Alswaidan, P. Ramasami “1-Formyl-3-phenyl-5-(4-isopropylphenyl)-2-pyrazoline: Synthesis, Characterization, Antimicrobial activity and DFT studies” (Journal of Molecular Structure, 2016, 1121, 46-53)

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146

L. N. Obasi, G. U. Kaior, L. Rhyman, I. A. Alswaidan, H. K. Fun, P. Ramasami “Synthesis, Characterization, Antimicrobial screening and Computational Studies of 4-[3-(4-Methoxy-phenyl)-allylideneamino]-1, 5-Dimethyl-2-phenyl-1, 2-Dihydro-pyrazol-3-one” (Journal of Molecular Structure, 2016, 1120, 180-186)

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145

C. Parlak, G. Keşan, L. Rhyman, P. Ramasami, S. Akgöl and Nadide Kazanci “1-Formyl-3-phenyl-5-(4-isopropylphenyl)-2-pyrazoline: Synthesis, characterization, antimicrobial activity and DFT studies” (Journal of Molecular Structure, 2016, 46-53)

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144

D. Hallooman, M. Ríos-Gutiérrez, L. Rhyman, I. A. Alswaidan, H.-K. Fun, L. R. Domingo and P. Ramasami “[3+2] Cycloaddition Reaction of 1H-Phosphorinium-3-olate and 1-Methylphosphorinium-3-olate with Methyl Acrylate: A DFT Study” (Computational and Theoretical Chemistry, 2016, 36-47)

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143

L. N. Obasi, G. U. Kaior, L. Rhyman, I. A. Alswaidan, H.-K. Fun and P Ramasami “Synthesis, Characterization, Computational Studies and Antimicrobial Screening of 4-[3-(4-Methoxy-phenyl)-allylideneamino]-1,5-dimethyl-2-phenyl-1,2-dihydro-pyrazol-3-one” (Journal of Molecular Structure, 2016, 180-186)

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142

M. M. Jadhav, L. Rhyman, P. Ramasami, N. Sekar.Unfolding ESIPT in Bis-2,5-(2-benzoxazolyl) hydroquinone and 2,5-Bis(benzo[d]oxazol-2-yl)-4-methoxyphenol: A Comprehensive Computational Approach” (Journal of Fluorescence, 2016, 1-13)

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141

A. Bundhun, P. Ramasami, P. P. Gaspar and H. F. Schaefer “Toward Unsaturated Stannylenes Y2Z=Sn: with Triplet Electronic Ground States” (RSC Advances, Accepted, 2016)

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140

V. Uahengo, B. Xiong, P. Cai, L: S. Daniel, L. Rhyman, P. Ramasami “Chromogenic signaling of water traces by 1, 8-naphthalohydrazone-anion complex in organic solvents” (Analytical Chemistry Research, 2016, 8, 1-8)

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139

P. S. Kharkar, P. Ramasami, Y. S. Choong, L. Rhyman and S. WarrierDiscovery of Anti-Ebola Drugs: A Computational Drug Repositioning Case Study(RSC Advances, 2016, 6, 26329-26340)

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138


T. Ford and P. Ramasami “The Structures and Vibrational Spectra of the Methyl Halide Dimers. An Ab initio study” (Journal of Molecular Structure, In Press, 2016)

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137

K. Singh, B. Chandra, L Rhyman and P. Ramasami “Potential Adsorption of Pyridine (Py) - Onto Powdered Activated Mustard Cake (PAMC): Kinetics and Equilibrium Adsorption” (Journal of Environmental Chemical Engineering , 2016, 4, 1383-1392)

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136

E. Agbo, T. J. Makhafola, Y. S. Choong, M. J. Mphahlele and P RamasamiSynthesis, Biological Evaluation and Molecular Docking Studies of the 6-Aryl-2-styrylquinazolin-4(3H)-ones” (Molecules, 2016, 21, 28)

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135

D. Kodi Ramanah, P. Surajbali, L. Rhyman, I. A. Alswaidan, H.-K. Fun, R. Somanah and P. Ramasami, “Ab initio Studies on Cyanoacetylenes of Astrochemical Interest: [Y(C≡C)CN, Y = C2H5, C3H7, C4H9, F, Cl, Br and CN]” (New Astronomy, 2016, 42, 42-48)

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134

J. Z. A. Laloo, L. Rhyman, P. Ramasami, F. M. Bickelhaupt and A. de Cózar “Ion-Pair SN2 Substitution: Activation Strain Analyses of Counter-Ion and Solvent Effects” (Chemistry: A European Journal, Accepted, 2016)

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133

H. Bhakhoa, L. Rhyman, E P. F. Lee, P. Ramasami and J. M. Dyke “A DFT Study of the Alkali Metal Azide-Cyclen Complexes: A Precursor to Synthesis of these Compounds (Chemistry: A European Journal, Accepted, 2016)

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132

S. N. Margar, L. Rhyman, P. Ramasami and N. Sekar, “Fluorescent Difluoroboron-Curcumin Analogues: An Investigation of the Electronic Structures and Photophysical Properties” (Spectrochimica Acta, Part A: Molecular and Bimolecular Spectroscopy, 2016, 152, 241-251)

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131

R. Takjoo, P. Ramasami, J. T. Mague, Z. Hasani and L. Rhyman, “Dioxidomolybdenum(VI) Complexes of Allyl N'-2-Hydroxy-3-methoxybenzylidenecarbamohydrazonothioate: Synthesis, Spectral and Theoretical Investigation” (Journal of Coordination Chemistry, In Press, 2016)

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130

H. H. Abdallah, P. H. Yeoh, L. Rhyman, I. A. Alswaidan, H.-K. Fun, Y. Umar and P. Ramasami, “Internal Rotation of 2-, 3- and 4- Pyridine carboxaldehydes and their Chalcogen Analogues (S and Se) in the Gas and Solution Phases: A Theoretical Investigation” (Journal of Solution Chemistry, Submitted, 2016)

129

Y. Jin, J. Zhao, L. Rhyman, P. Ramasami, Y. Shin, K. Min Jeong, J. Lee, “A Novel Method for Chiral Determination of Etodolac by Derivatization with (1R)-(-)-Menthyl Chloroformate Followed by Salting-Out Assisted Liquid-Liquid Extraction and Liquid Chromatography-Fluorescence Detection” (Arabian Journal of Chemistry, In Press, 2016)

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128

H. K. Paumo, M. J. Mphahlele, L. Rhyman, P. Ramasami, “Synthesis and Evaluation of Photophysical Properties of Novel Polycarbo-substituted Quinazolines Derived from the 2-Aryl-6-bromo-4-chloro-8-iodoquinazolines” (Tetrahedron, 2016, 72, 123-133)

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2016

127

N. Seeburrun, I. A. Alswaidan, H.-K. Fun, E. F. Archibong and P. Ramasami, “Probing the Structural and Electronic Properties of Doped Gallium Oxide and Sulfide, M(GaX2)2 where M = alkali or coinage metal; X = O, S” (RSC Advances, 2015, 106141-106150)

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126

N. Seeburrun, I. A. Alswaidan, H.-K. Fun, E. F. Archibong and P. Ramasami, “A Comparative Ab initio Study to Investigate the Rich Structural Variety and Electronic Properties of GamTen (m = 1, 2 and n = 1–4) with Analogous Oxides, Sulfides and Selenides (RSC Advances, 2015, 68076-68084)

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125

K. Ghoonia, H. Jhurree, L. Rhyman, I. A. Alswaidan, H. K. Fun, R. Somanah and P. Ramasami, “Structural, Spectroscopic and Energetic Parameters of P-bearing Species having Astrophysical Importance” (Cogent Physics, 2015, 2, 1070661A). 

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124

C. Parlak, M. Tursun, C. S. Chidan Kumar, D. Bilge, N. Kazanci, L. Rhyman and P. Ramasami, “Halogen and Solvent Effects on the Conformational, Vibrational and Electronic Properties of 1,4-Diformylpiperazine: A Combined Experimental and DFT Study” (Journal of Theoretical and Computational Chemistry, In Press, 2015)

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123

M. J. Mphahlele, H. K. Paumo, L. Rhyman, P. Ramasami, “Synthesis and Photophysical Properties of Polycarbo-Substituted Quinazolines Derived from the 2-Aryl-4-chloro-6-iodoquinazolines” (Molecules, 2015, 20, 14656-14683)

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122

A. B. Tathe, L. Rhyman, P. Ramasami and N. Sekar, “Red Emitting Coumarins: Insights of Photophysical Properties with DFT Methods” (Journal of Fluorescence, 2015, 25, 1117-1126)

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121

J. M. Dyke, W. Levason, M. Light, D. Pugh, G. Reid, H. Bhakhoa, P. Ramasami and L. Rhyman, “Aza-macrocyclic Complexes of the Group 1 cations – Synthesis, Structures and Density Functional Theory Study” (Dalton Transactions, 2015, 44, 13853-13866)

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120

K. Gör, M. Tursun, G. Keşan, G. S. Kürkçüoğlu, L. Rhyman, C. Parlak, P. Ramasami, O. Z. Yeşilel and O. Büyükgüngör, “Novel Cyanide-bridged Heterometallic Two-Dimensional Complex of 3-Methylpyridazine: Synthesis, Crystallographical, Vibrational, Thermal and DFT Studies” (Journal of Inorganic and Organometallic Polymers and Materials, 2015, 25, 1205-1217)

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119

C. Parlak, M. Gökce, M. Tursun, L. Rhyman and P. Ramasami, “Conformational, Vibrational and Electronic Properties of CH3(CH2)3CX2NH2 (X = H, F, Cl or Br): Halogen and Solvent Effects” (Journal of Theoretical and Computational Chemistry, 2015, 14, 1550031)

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118

X. Schoultz, T. I. A. Gerber, E. Hosten, R. Betz, L. Rhyman and P. Ramasami, “The Reaction of [ReIIICl3(t-BuNC)(PPh3)2] with Aniline Derivatives: Isolation of Imido-Re(V) Complexes and a Re(III) Complex Containing Iminobenzoquinonate as Ligand” (Polyhedron, 2015, 96, 6-15)

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117

C. Parlak, P. Ramasami, C. S. Chidan Kumar, M. Tursun, C. Kheng Quah, L. Rhyman, M. Bilge, H.-K. Fun and S. Chandraju, “(2E)-1-(5-chlorothiophen-2-yl)-3-{4-[(E)-2-phenylethenyl] phenyl}prop-2-en-1-one: Synthesis, XRD, FT-IR, Raman and DFT studies” (Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2015, 149, 385-395)

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116

P. Surajbali, D. Kodi Ramanah, L. Rhyman, I. A. Alswaidan, H.-K. Fun, R. Somanah and P. Ramasami, “Density Functional Theory Study of Cyanoetheneselenol: A Molecule of Astrobiological Interest” (Origins of Life and Evolution of Biospheres, In 2015, 45, 465-468)

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115

M. Tursun, C. Sadolalu C. Kumar, M. Bilge, L. Rhyman, H. K. Fun, C. Parlak, P. Ramasami, S. Chandraju and C. K. Quah, “Crystal Structure, Vibrational Spectra and DFT Simulations of 2-Fluoro-4-bromobenzaldehyde”

(Spectrochimica Acta, Part A: Molecular and Bimolecular Spectroscopy, 2015, 146, 342-349)

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114

L. Rhyman, P. Ramasami, J. A. Sáez and L. R. Domingo “Diels Alderase Catalysing the [4+2] Cycloaddition in the Biosynthesis of Spinosyn A: Reality or Fantasy?”

(Book Chapter: Emerging Trends in Computational Biology, Bioinformatics, and Systems Biology - Algorithms and Software Tools, Publisher: Elsevier/MK, 2015)

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113

U. Warde, L. Rhyman, P. Ramasami and Nagaiyan Sekar “DFT Studies of the Photophysical Properties of Fluorescent and Semiconductor Polycyclic Benzimidazole Derivatives”

(Journal of Fluorescence, 2015, 25, 685-694)

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112

N. Seeburrun, E. F. Archibong and P Ramasami “Mono and Digallium Selenide Clusters as Potential Superhalogens”

(Journal of Molecular Modeling 2015, 21, 1-12)

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111

C. S. C. Kumar, C. Parlak, M. Tursun, H. K. Fun, L. Rhyman, P. Ramasami, I. A. Alswaidan, G. Keşan, S. Chandraju and C. K. Quah “3-Iodobenzaldehyde: Combined XRD, FT-IR, Raman and DFT studies”

(Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2015, 145, 90-97)

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110

M. Tursun, L. Rhyman, C. Parlak, P. Ramasami and M. Şenyel “Conformations and NH stretching of 1,1-Dihalogeno-hepta-1-amines (CH3(CH2)5CX2NH2; X = F, Cl or Br): Halogen and solvent effects

(Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2015, 139, 171-178)

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109

M. J. D. Champion, J. M. Dyke, W. Levason, M. E Light, D. Pugh, H. Bhakhoa, L. Rhyman, P. Ramasami, G. Reid “Sodium Thioether Macrocyclic Chemistry: Remarkable Homoleptic Octathia Coordination to Na+

(Inorganic Chemistry, 2015, 54, 2497-2499)

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108

C. Parlak, P. Ramasami, M. Tursun, L. Rhyman , M. F. Kaya, N. Atar, Özgür Alver and Mustafa Şenyel “Influence of Intermolecular Hydrogen Bond on OH Stretching of 4-Mercaptophenylboronic Acid: FT-IR, Raman and DFT studies”

(Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2015, 144, 131-138)

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107

L. Rhyman, I. A. Alswaidan, H. K. Fun, J. A. Joule and P. Ramasami “Theoretical Insight into the Effect of Fluorine Substituents on the Rearrangement Step in Fischer Indolisations”

(Tetrahedron, 2015, 71, 7199-7203).

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106

T. Ford and P. Ramasami “Chalcogen-bonded Complexes. Selenium-bound adducts of NH3, H2O, PH3 and H2S with OCSe, SCSe and CSe2

(Journal of Molecular Modeling, 2015, 21, 1-7)

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105

P. Ramasami and T. A. Ford “Chalcogen-bonded Complexes of Some Carbon dioxide Analogues”

(Journal of Molecular Structure, 2014, 1072, 28-31)

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104

P. Ramasami, L. Rhyman and N. Jaufeerally “An Experience in the Digital Age”

Chemistry International, 2014, 36, 8-9

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103

V. S. Padalkar, P. Ramasami and N. Sekar “A Comprehensive Spectroscopic and Computational Investigation of Intramolecular Proton Transfer in the Excited States of 2-(2′-hydroxyphenyl) benzoxazole and its Derivatives”

(Journal of Luminescence, 2014, 146, 527-538)

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102

K. G. Thorat, H. Bhakhoa, P. Ramasami and Nagaiyan Sekar “NIR-Emitting Boradiazaindacene Fluorophores-TD-DFT Studies on Electronic Structure and Photophysical Properties

(Journal of Fluorescence, 2014, 25, 69-78)

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101

N. Seeburrun, H. H. Abdallah, E. F. Archibong and P. Ramasami "Structural and Electronic Properties of the Neutral and Anionic Gallium Selenide Clusters"

(Journal of Molecular Modeling, 2014, 25, 755-766)

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100

N. B. Jaufeerally, P. Ramasami, P. Jerabek and G. Frenking “Bonding Analysis of Telluroketones H2A=Te ( A = C, Si, Ge]”

(Journal of Molecular Modeling, 2014, 20, 1-8)

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99

N. Sekar, P. G. Umape, V. S. Padalkar, R. P. Tayade and P. Ramasami “Synthesis of Novel Styryl Derivatives from 4-chloro-2-(morpholin-4-yl)-1, 3-thiazole-5-carbaldehyde, Study of their Photophysical Properties and TD-DFT Computations”

(Journal of Luminescence, 2014, 150, 8-18)

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98

C. S. C. Kumar, H. K. Fun, C. Parlak, L. Rhyman, P. Ramasami, M. Tursun, S. Chandraju and C. K. Quah “Synthesis, Molecular Structure, FT-IR, Raman, XRD and Theoretical Investigations of (2E)-1-(5-chlorothiophen-2-yl)-3-(naphthalen-2-yl) prop-2-en-1-one”

(Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2014, 132, 174-182)

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97

C. Parlak, C. S. C. Kumar, H. K. Fun, G. Keşan, L. Rhyman, P. Ramasami, S. Chandraju and C. K. Quah “4-Chloro-3-fluorobenzaldehyde: Experimental (XRD, FT-IR and Raman) and DFT studies”

(Journal of Fluorine Chemistry, 2014, 163, 7-15)

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96

N. B. Jaufeerally, H. H. Abdallah, P. Ramasami and H. F. Schaefer III “Novel Germanetellones: XYGe=Te (X, Y=H, F, Cl, Br, I and CN) – Structures and Energetics. Comparison with the First Synthetic Successes”

(Dalton Transactions, 2014, 43, 4153-4162)

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95

P. Ramasami and T. Ford "Structural, Energetic and Vibrational Properties of Some van der Waals complexes of CO2, OCS and OCSe"

(Molecular Physics, 2014, 112, 683-693)

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94

R. Takjoo, P. Ramasami, A. Hashemzadeh, L. Rhyman, H. A. Rudbari and F. Nicolò “An Integrated Experimental and Theoretical Investigation of the Structural and Spectroscopic of Two Novel Nickel(II) Isothiosemicarbazone Complexes”(Journal of Coordination Chemistry, 2014, 67, 1-24)

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93

A. B. Tathe, V. D. Gupta, M. R. Shreykar, P. Ramasami, N. Sekar “Excited State Intramolecular Proton Transfer of 2-(2',6'-Dihydroxyphenyl)Benzoxazole: Insights using Computational Methods” (Journal of Luminescence, 2014, 154, 267-273)

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92

A. Bundhun, M. D. Ramdany, J. S. Murray, P. Ramasami “Density Functional Theory Sudy of Te(CN)2, Te(CN)(NC) and Te(NC)2 and their Isomerizations” (Structural Chemistry, 2014, 24, 2047-2057)

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91

K. C. Potgieter, T. I. A. Gerber, R. Betz, L. Rhyman, P. Ramasami “Structural and DFT/TD-DFT investigation of tris(bidentate) complexes of rhenium(III) synthesized from the cis-[ReO2]+ core and benzenethiol derivatives” (Polyhedron, 2013, 59, 839-851)

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90.

L. Rhyman, L. R. Domingo, J. A. Joule, P. Ramasami “Regio- and Stereoselectivity of the 1,3-Dipolar Cycloaddition of C-Methyl Substituted Pyrazinium-3-olates with Methyl Acrylate and Methyl Methacrylate: A Density Functional Theory Exploration (Computational and Theoretical Chemistry, 2013, 1025, 58-66)

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89.

V. S. Padalkar, P. Ramasami, N. Sekar “TD-DFT Study of Excited-State Intramolecular Proton Transfer (ESIPT) of 2-(2'-Hydroxyphenyl) Imidazole Derivatives” (Journal of Fluoresence, 2013, 23, 839-851)

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88.

V. S. Padalkar, P. Ramasami, N. Sekar “A Comprehensive Spectroscopic and Computational Investigation of Intramolecular Proton Transfer in the Excited States of 2-(2'-Hydroxyphenyl) Benzoxazole and its Derivatives” (Journal of Luminescence, 2013, 146, 527-538)

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87.

V. S. Padalkar, P. Ramasami, N. Sekar “TD-DFT Study of Excited-State Intramolecular Proton Transfer (ESIPT) of 2-(1,3-Benzothiazol-2-yl)-5-(N,N-Diethylamino)Phenol and its comparative study with 2-(1,3-Benzoxazole and Benzimidazole-2-yl)-5-(N,N-Diethylamino)Phenol”(Procedia Computer Science, 2013, 18, 797-805)

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86.

N. B. Jaufeerally, P. Ramasami “A First Principle Attempt towards the Thermodynamic Stability of Telluroformaldehyde and Heavier Analogues: H(n)X(2-n)A=Te (X=H, F, Cl and Br; A=C, Si and Ge; n=0, 1 and 2)” (Procedia Computer Science, 2013, 18, 806-815)

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85.

N. B. Jaufeerally, H. H. Abdallah, P. Ramasami, H. F. Schaefer III “A Journey Through the Potential Energy Surfaces of the Isomerization and Decomposition Reactions of H2X=Te and HFX=Te (X=C, Si and Ge)” (Journal of Physical Chemistry A, 2013, 117, 5567-5577)

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84.

L. R. Domingo, J. A. Sáez, J. A. Joule, L. Rhyman and P. Ramasami " A DFT Study of the [3+2] versus [4+2] Cycloaddition Reactions of 1,5,6-Trimethyl-pyrazinium-3-olate with Methyl Methacrylate" (Journal of Organic Chemistry, 2013, 78, 1621-1629)

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83.

P. Ramasami, H. H. Abdallah, E. T. Archibong, P. Blowers, T. Ford, R. Kakkar, Z. Shuai and H. F. Schaefer III "Assessment of Theoretical Methods for the Study of Kinetics of Global Warming Gas Species Degradation and Byproduct Formation" (Pure and Applied Chemistry, 2013, 85, 1901-1918)

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82.

N Jaufeerally, H. H. Abdallah and P. Ramasami "Novel Silanetellurones: Structures, Ionization Potentials, Electron Affinities, Singlet-Triplet Splittings and Kohn-Sham HOMO-LUMO Gaps of the X2Si=Te and XYSi=Te (X, Y=H, F, Cl, Br, I and CN) Systems" (Computational and Theoretical Chemistry, 2013, 1016, 62-72)

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81.

P. Gohee, H. H. Abdallah, E. F. Archibong, P. Ramasami "First Principles Gas Phase Study of the Structures, Energetics and Spectroscopic Parameters of Aluminium Antimonide, AlxSby (x+y = 3,5), Nanoclusters)" (European Physical Journal D, 2013, 67, 171-179)

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80.

N. Seeburrun, H. H. Abdallah, E. F. Archibong and P. Ramasami "Unveiling the Structural and Electronic Properties of the Neutral and Anionic Gallium Sulfide clusters" (Structural Chemistry, 2013)

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79.

V. D. Gupta, A. B. Tathe, V. S. Padalkar, V. S. Patil, K. R. Phatangare,P. G. Umape, P. Ramasami and N. Sekar "TDDFT Investigation of the Electronic Structures and Photophysical Properties of Fluorescent Extended Styryl Push-Pull Chromophores Containing Carbazole Unit" (Journal of Fluorescence, 2013, 23, 1121-1138)

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78.

A. Bundhun, P. Ramasami, J. S. Murray and P. Politzer "Trends in σ-Hole Strengths and Interactions of F3MX Molecules (M = C, Si, Ge and X = F, Cl, Br, I)" (Journal of Molecular Modelling, 2013, 19, 2739-2746)

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77.

K. R. Phatangare,V. D. Gupta, A. B. Tathe, Vikas S. Padalkar, Vikas S. Patil, P. Ramasami and N. Sekar "ESIPT Inspired Fluorescent 2-(4-benzo[d]oxazol-2-yl)naphtho[1,2-d]oxazol-2-yl)phenol: Synthesis and DFT Based Approach to Photophysical Properties" (Tetrahedron, 2013, 69, 1767-1777)

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76.

W. Hermoso, N. Jaufeerally, P. Ramasami and F. Ornellas "Exploring New Species on the [H, S, Se, Cl] Potential Energy Surface" (International Journal of Quantum Chemistry, 2013, 113, 112-118)

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75.

L. Rhyman, L. R. Domingo, J. A. Sáez, J. A. Joule and P. Ramasami "A DFT Analysis of the Lewis Acid Catalyzed Reaction between Methyl Glyoxylate Oxime and Cyclopentadiene. 1,3-Dipolar Cycloaddition versus Hetero-Diels-Alder Reaction." (RSC Advances, 2013, 3, 447-457)

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74.

A. Bundhun, H. H. Abdallah, P. Ramasami, P. Gaspar and H. F Schaefer "Dicyanogermylenes: A Tale of their Isomers and Interconversions" (Inorganic Chemistry, 2012, 51, 12152-12164)
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73.

L. Rhyman, N. Armata, P. Ramasami and John M. Dyke "A Study of the Atmospherically Important Reactions Between Dimethyl Selenide (DMSe) and X2 (X2 = Cl2, Br2 and I2) with Ab Initio Calculations" (Journal of Physical Chemistry, Accepted, 2012, 116, 5595-5603)

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72.

P. Ramasami and T. Ford "Ab initio Studies of Some Hydrogen-bonded Complexes of Fluoroform-Evidence for Blue-shifted Behavior" (Journal of Molecular Structure, 2012, 1023, 163-169)

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71.

L. Rhyman, S. Jhaumeer-Laulloo, L. R. Domingo, J. A. Joule and P. Ramasami "Regio- and Stereoselectivity of the 1,3-Dipolar Cycloaddition of Pyridinium-3-olates and Pyrazinium-3-olates with Methyl Methacrylate: A Density Functional Theory Exploration" (Current Organic Chemistry, 2012, 16, 1711-1722)

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70.

R. Takjoo, R. Centore, L. Rhyman and Ponnadurai Ramasami "Nickel(II) and Copper(II) Complexes of Allyl 2-(thiophen-2-ylmethylene)hydrazinecarbodithioate: Synthesis, X-ray crystal structures and Theoretical study (Journal of Coordination Chemistry, 2012, 65, 1569-1579)
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69.

N. Seeburrun, H. H. Abdallah and P. Ramasami "From Matrix Isolation to Computational Investigation: A Closer Look at Digallium Tetraoxide, Ga2O4" (Journal of Physical Chemistry A, 2012, 116, 3215-3223)
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68.

M. Soopramanien, N. Seeburrun, H. H. Abdallah, E. F. Archibong and P. Ramasami "Ga2Te3 and Ga3Te2 Clusters: Understanding their Structures, Vibrational and Energetic Features using Ab initio Methods" (Journal of Material Science, 2012, 47, 4332-4341)
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67.

S. Beccaceci, N. Armata, S. J. Ogden, L. Rhyman, J. M. Dyke and P. Ramasami "A Study of the Atmospherically Important Reactions of I2 and ICl with Dimethylsulphide (DMS) using Infrared Matrix Isolation Spectroscopy and Electronic Structure Computations" (Physical Chemistry Chemical Physics, 2012, 14, 2399-2407)
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66.

A. Bundhun, P. Ramasami, P. Gaspar and H. F Schaefer "Stannylenes: Structures, Electron Affinities, Ionization Energies and Singlet-Triplet Gaps of SnX2/SnXY and XSnR/SnR2/RSnR' Species (X; Y = H, F, Cl, Br, I, and R; R′ = CH3, SiH3, GeH3, SnH3)" (Inorganic Chemistry, 2012, 51, 851-863)
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65.

N. Jaufeerally, H. H. Abdallah, P. Ramasami and H. F Schaefer "Telluroformaldehyde and its Derivatives: Structures, Ionization Potentials, Electron Affinities and Singlet-Triplet Gaps of the X2CTe and XYCTe (X,Y=H, F, Cl, Br, I and CN) Species" (Theoretical Chemistry Accounts, 2012, 131, 1127-1149)
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64.

P. Ramasami and T. Ford "An initio Studies of the Properties of Some Halogen-Bonded Complexes of Ammonia, Water, Phosphine and Hydrogen Sulphide" (Computational and Theoretical Chemistry, 2012, 990, 227-235)
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63.

L. Rhyman, S. Jhaumeer-Laulloo, L. R. Domingo, J. A. Joule and P. Ramasami "Computational Assessment of 1,3-Dipolar Cycloaddition of Nitrile Oxides with Ethene and [60]Fullerene" (Heterocycles, 2012, 84, 719-735) (Invited paper)
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62.

L. Rhyman, H. H. Abdallah, S. Jhaumeer-Laulloo, L. R. Domingo, J. A. Joule and P. Ramasami "1,3-Dipolar Cycloaddition of 1H-Pyrazinium-3-olate and N1- and C-Methyl Substituted Pyrazinium-3-olates with Methyl acrylate: A Density Functional Theory Study" (Tetrahedron, 2011, 67, 8383-8391)
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61.

L. Rhyman and P. Ramasami "Molecular Structures and Vibrational Spectra of Roesky's Ketone, its Isomers and their Novel Sulfur and Selenium Analogues: An Insight using Density Functional Theory" (Pakistan Journal of Chemistry, 2011, 1, 48-59) (Invited paper)
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60.

N. Seeburrun, H. H. Abdallah, E. F. Archibong and P. Ramasami "Geometries and electronic structures of Ga2Se3, Ga3Se2 and their anions. Theoretical insights" (European Physical Journal D, 2011, 63, 351-358)
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59.

E. F. Archibong and P. Ramasami "On the Molecular and Electronic Structure of GaO4" (Computational and Theoretical Chemistry, 2011, 964, 324-328)
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58.

L. Rhyman, H. H. Abdallah and P. Ramasami "Quantum Mechanical Study of the Syn-Anti Isomerisation of 2-Tellurophenecarboaldehyde: Vive La Différence" (Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2011, 78, 258-263)

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57.

B. Bhonoah, A. Ghoorun, H. H. Abdallah, P. Ramasami "Theoretical Study of the Gauche and Trans Conformers of SiH2X-CH2X, SiH2F-CH2Y and SiH2Y-CH2F (X=F, Cl, Br, I and Y=Cl, Br, I) in the Gas and Solution Phases" (Journal of Solution Chemistry, 2011, 40, 430-436)

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56.

L. Rhyman, H. H. Abdallah, S. Jhaumeer-Laulloo, L. R. Domingo, J. A. Joule and P. Ramasami "The 1,3-Dipolar Cycloaddition of 1H-Pyridinium-3-olate and 1-Methylpyridinium-3-olate with Methyl Acrylate: A Density Functional Theory Study" (Tetrahedron, 2010, 66, 9187-9193)

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55.

A. Bundhun, H. H Abdallah, P. Ramasami and H. F Schaefer "Germylenes: Structures, Electron Affinities, and Singlet-Triplet Gaps of the Conventional XGeCY3 (X = H, F, Cl, Br, and I; Y = F and Cl) Species and the Unexpected Cyclic XGeCY3 (Y = Br and I) Systems" (Journal of Physical Chemistry A, 2010, 114, 13198-13212)

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54.

P. Ramasami and T. Ford “Ab Initio Studies of the Vibrational Spectra of Some Hydrogen-bonded Complexes of Fluoroacetylene” (Canadian Journal of Chemistry, 2010, 88, 716-724)
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53.

P. Ramasami “First Principle Study of the Trans and Gauche Rotamers of 1,2-Dihalogenodisilanes (XSiH2SiH2X; X=F, Cl, Br, I) in Vacuum” (Procedia Computer Science series, 2010, 1, 1133-1140)
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52.

A. Bundhun and P. Ramasami “Density Functional Theory Study of the Carbon Chains CnX, CnX+ and CnX (X = O and Se; n = 1–10)” (European Physical Journal D, 2010, 57, 355-364)
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51.

A. Bundhun, P. Blowers, P. Ramasami and H. F. Schaefer “Quantum Mechanical Modeling for the GeX2/GeHX + GeH4 Reactions (X = H, F, Cl, and Br)” (Journal of Physical Chemistry, 2010, 114, 4210-4223)
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50.

L. Rhyman, H. H. Abdallah and P. Ramasami “Quantum Mechanical Study of the Structure and Spectroscopic Characterisation of the Novel Trisilylsilylcyanide and Trigermylgermylcyanide in the Gas Phase (Polyhedron, 2010, 29, 1168-1174)
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49.

P. Ramasami and T. A. Ford  “An Ab Initio Molecular Orbital Study of the Complexes Formed Between Silicon Tetrafluoride and some Lewis Bases” (Journal of Molecular Structure THEOCHEM, 2010, 940, 50-55)
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48.

L. Rhyman, H. H. Abdallah and P. Ramasami “Theoretical Study of the Structural, Spectroscopic and Energetic Properties of Difluoro(germylthio)phosphine and Difluoro(germylseleno)phosphine in the Gas Phase” (Polyhedron, 2010, 29, 220-225)
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47.

E. F. Archibong, N. Seeburrun and P. Ramasami “Geometric and Electronic Structure of AlO4 and AlO4−” (Chemical Physics Letter, 2009, 481, 169-172)
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46.

H. H. Abdallah and P. Ramasami “Rotational Barrier, Energy difference and Thermodynamic Parameters of 2-Furoylfluoride and its Sulfur and Selenium Analogues in the Gas and Solution Phases:  A Theoretical Study” (Journal of Molecular Structure THEOCHEM, 2009, 913, 157-161)
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45.

A. Bundhun, P. Ramasami and H. Schaefer "Germylene Energetics: Electron Affinities and Singlet−Triplet Gaps of GeX2 and GeXY Species (X, Y = H, CH3, SiH3, GeH3, F, Cl, Br, I)" (Journal of Physical Chemistry, 2009, 113, 8080-8090)
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44.

P. Ramasami "Theoretical Study of 2-Selenophenecarboaldehyde in the Gas and Solution Phases: Rotational Barrier, Energy difference and Thermodynamic Parameters" (Journal of Molecular Structure THEOCHEM, 2009, 907, 57-61)
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43.

P. Ramasami "Structure and Vibrational Spectroscopic Parameters of Selenoxopropanedinitrile and Selenoxosilanedicarbonitrile. Theoretical Study Based on Density Functional Theory Method" (Heteroatom Chemistry, 2009, 20, 208-217)
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42.

L. Rhyman, H. H. Abdallah and P. Ramasami “Theoretical Study of the Structures, Conformations and Spectroscopic Properties of 2-Formylthiophene N-acetylhydrazone and 2-Thiophenecarboxaldehyde 2-thienylhydrazone” (Heteroatom Chemistry, 2009, 20, 144-150)
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41.

H. H. Abdallah and P. Ramasami "First Principle Study of the Anti- and Syn-Conformers of Thiophene-2-carbonyl Fluoride and Selenophene-2-carbonyl Fluoride in the Gas and Solution Phases" (Lecture Notes in Computer Science, 2009, 5545, 114-121)
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40.

N. Seeburrun, P. Gohee, H. H. Abdallah, L. Kanime, E. F. Archibong and P. Ramasami “Electronic structures of Al4As, Ga4As and their anions” (Chemical Physics Letters, 2009, 472, 35-38)
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39.

N. Seeburrun, E. F. Archibong and P. Ramasami “Structures and Electron Detachment Energies of Ga2S3- and Ga3S2-” (Chemical Physics Letters, 2008, 467, 23-27)
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38.

P. Ramasami “First Principle Gas Phase Study of the Trans and Gauche Rotamers of 1,2-Diisocyanoethane, 1,2-Diisocyanodisilane and Isocyano(isocyanomethyl)silane” (Lecture Notes in Computer Science, 2008, 5102, 344-352)
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37.

R. Sreeruttun, P. Ramasami, C. Wannere, A. Andrew and H. Schaefer “a and b-Phenylethynyl Radicals and their Isomers o-, m and
p-Ethynylphenyl: Structures, Energetics, and Electron Affinities” (Journal of Physical Chemistry, 2008, 112, 2838-2845)
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36.

F. Kinoo and P. Ramasami “Molecular structure, Atomisation energy, Ionisation energy, Electron affinity, and Vibrational spectrum of SiX2 (X=F, Cl, Br, I) by Theoretical Methods” (Main Group Chemistry, 2008, 7, 57-64)
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35.

P. Ramasami “DFT Study of the Molecular Structures, Infrared and Raman spectra of 1,5-Dichloropenta-1,4-diyn-3-one, 1,5-Dibromopenta-1,4-diyn-3-one, 1,5-Diiodopenta-1,4-diyn-3-one, their Sulfur, and Selenium analogues”(Journal of Sulfur Chemistry, 2008, 29, 475-488)
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34.

H. Ashish and P. Ramasami “Rotational Barrier and Thermodynamical Parameters of Furfural, Thiofurfural, and Selenofurfural in the Gas and Solution Phases: Theoretical Study Based on Density Functional Theory Method” (Molecular Physics, 2008, 106, 175-185)
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33.

P. Ramasami “Density Functional Study of the Molecular Structures, Infrared and Raman spectra of Carbon Suboxide, its Sulfur and Selenium analogues”(Molecular Physics, 2007, 105, 1067 - 1072)
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32.

P. Ramasami "Theoretical Gas Phase Study of the Gauche and Trans Conformers of 1-Bromo-2-Iodoethane and Solvent Effects" (Solution Chemistry, 2007, 36, 901-911)
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31.

P. Ramasami "Theoretical Gas Phase Study of the Gauche and Trans Conformers of 1-Bromo-2-Chloroethane and Solvent Effects" (Lecture Notes in Computer Science. 2007, 4488, 296-303)
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30.

P. Ramasami "Gas Phase Study of the Trans and Gauche Rotamers of 1,2-Dicyanoethane, Novel 1,2-Dicyanodisilane and Cyano(cyanomethyl)silane by Ab Initio and Density Functional Methods" (Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 2007, 68, 752-726)
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29.

F. Kinoo and P. Ramasami “Performance of Theoretical Methods and Basis sets on the
Molecular Structure, Atomisation and Ionisation energies, Electron affinity,
and Vibrational Spectrum of Silylene” (Silicon chemistry, 2007, 3, 251-257)
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28.

P. Ramasami “Novel 1,5-difluoropenta-1,4-diyn-3-one, its Sulfur and Selenium Analogues: MP2 and DFT Gas Phase Study of their Molecular Structures and Vibrational Spectra” (Journal of Molecular Structure THEOCHEM, 2006, 775, 87-92)
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27.

K. Khodabux, M. S. S. L'Omelette, S. Jhaumeer-Laulloo, P. Ramasami and P. Rondeau "Chemical and Near-infrared Determination of Moisture, Fat and Protein in Tuna Fishes" (Food Chemistry, 2007, 102, 669-675)
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26.

P. Ramasami "A Theoretical Gas Phase Study of the Molecular Structures and Vibrational Spectra of Novel Penta-1,4-diyne-3-thioketone and Penta-1,4-diyne-3-selenoketone" (Journal of Molecular Structure THEOCHEM, 2006, 767, 19-22)
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25.

P. Ramasami "Gas Phase Study of the Gauche and Trans Conformers of 1-Fluoro-2-Haloethanes CH2F-CH2X (X=Cl, Br, I) by Ab initio and Density Functional Methods: Absence of Gauche Effect" (Lecture Notes in Computer Science. 2006, 3993, 153-160)
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24.

R. K. Sreeruttun and P. Ramasami "Conformational Behaviour of 1,2-Dichloroethane and 1,2-Dibromoethane: 1H-NMR, IR, Refractive index and Theoretical Studies" (Physics and Chemistry of Liquids, 2006, 44, 315-328)
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23.

P. Ramasami and R. Kakkar "Partial Molar Volumes and Adiabatic Compressibilities at |Infinite Dilution of Aminocarboxylic acids and Glycylglycine in Water and Aqueous Solutions of Sodium Sulphate at 288.15, 298.15 and 308.15 K" (Journal of Chemical Thermodynamics, 2006, 38, 1385-1395)
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22.

P. Ramasami "Heat of Reaction of the Gas Phase Catalytic Decomposition Processes of Ozone: A comparison of Theoretical Methods" (Proceedings of the International Congress of Chemistry and Environment (ICCE-2005), India, 2005, 294-296)

21.

R. K. Sreeruttun, P. Ramasami, C. S. Wannere, A. Paul, P.v. R. Schleyer and H. F. Schaefer III "Effects of Fluorine on the Structures and Energetics of the Propynyl and Propargyl Radicals and Their Anions" (Journal of Organic Chemistry 2005, 70, 8676 – 8686)
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20.

P. Ramasami "Gauche and Trans Conformers of 1,2-Dihaloethanes: A Study by Ab initio and Density Functional Methods" (Lecture Series on Computer and Computational Sciences, 2005, 4, 732-734)

19.

B. A. Dilmohamud, J Seeneevassen, S. D. D. V. Rughooputh and P. Ramasami: “Surface Tension and Related Thermodynamic Parameters of Alcohols using Traube Stalagmometer” (European Journal of Physics, 2005, 26, 1079-1084)
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18.

S. Jhaumeer-Laulloo and P. Ramasami: “Infrared Spectroscopy: An Analytical Tool in Food Science” (Proceedings of the 7th Meeting of Agricultural Scientists, Mauritius, 2005, 43-50)
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17.

P. Ramasami and S. Jhaumeer-Laulloo: “Spectroscopic Quantitative Analysis of Food: Chemometrics is a Vital Tool” (Proceedings of the 7th Meeting of Agricultural Scientists, Mauritius, 2005, 35-42)
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16.

P. Ramasami: “Theoretical Studies of 1,2-Dichloroethane and 1,2-Dibromoethane in Gaseous Phase, Liquid Phase and Alcohol as Solvent” (Mansura Journal of Chemistry, 2005, 32, 127-137)

15.

P. Ramasami: “Changing Culture with Virtual Meetings” (Accepted for IRFD World Forum (Side Events and Virtual Conference) on Small Island Developing States: Challenges, Prospects and International Cooperation for Sustainable Development, Mauritius, Jan 2005)
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14.

  P. Ramasami: “A learning experience: Computational Chemistry as a Tool for Conformational analysis” (Australian Journal of Chemical Education, 2005, 65, 16-19)

13.

P. Ramasami, S. Jhaumeer-Laulloo, F. Cadet, P. Rondeau and Y. Soophul: “Quantification of Alcohol in Beverages by Density and Infrared Spectroscopy Methods” (International Journal of Food Sciences and Nutrition, 2005, 56, 177 – 183)
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12.

R. K. Sreeruttun, P. Ramasami, G Yan, C. S. Wannere, P. v. R. Schleyer and H. F. Schaefer: “The Alkylethynyl Radicals, ·CºC-CnH2n+1 (n=1-4), and their Anions'" (International Journal of Mass Spectrometry, 2005, 241, 295-304)
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11.

S. Jhaumeer-Laulloo and P. Ramasami: “Monitoring Browning and Sugar Content Of Litchi After Post Harvest Treatment" (Chemistry, An Indian Journal, 2004, 1, 610-611)

10.

N. Salim and P. Ramasami:  “Applications of Potentiometric Titrations" (Chemistry, An Indian Journal, 2004, 1, 607-609)

9.

P. Ramasami, S. Jhaumeer-Laulloo, P. Rondeau, F. Cadet, H Seepujak and A Seeruttun: "Quantification of Sugar in Beverages and Fruit Juices by Different Methods" (South African Journal of Chemistry, 2004, 57, 24-27)
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Available for free download

8.

P. Ramasami, D. N. Moothoosamy and R. Goojha: "Kinetics of the Reaction between Peroxodisulphate (VI) and Iodide ions." (Asian Journal of Chemistry, 2004, 16, 85-88)
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7.

S. Jhaumeer-Laulloo, P. Rondeau, F. Cadet and P. Ramasami: “Quantitative Determination of Sugar in some Common Fruits by Different Methods.” (Chemistry, An Indian Journal, 2003, 1, 131-136)

6.

P. Ramasami and P. Ramburrun: "Non-aqueous Conductimetric Titrations of Phenolic Compounds with Tetrabutylammonium Hydroxide and Amines against Perchloric acid in Acetonitrile Solvent” (Asian Journal of Chemistry, 2003, 15, 1539-1544)

5.

P. Ramasami: "A Concise Description of an old Problem: Application of Matrices to obtain the Balancing Coefficients of Chemical Equations." (Journal of Mathematical Chemistry, 2003, 34, 123-129)
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4.

P. Ramasami and P. Ramburrun: "Applications of Conductimetric Titrations" (Research Journal of Chemistry and Environment, 2003, 7, 48-53)
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3.

P. Ramasami: "Solubilities of Amino Acids in Water and Aqueous Sodium Sulphate and Related Apparent Transfer Properties" (Journal of Chemical Engineering Data, 2002, 47, 1164-1166)
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2.

P. Ramasami: "Students as Solids, Liquids and Gases" (Journal of Chemical Education, 2000, 77, 485)
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1.

R. K. Wadi and P. Ramasami: "Partial Molal Volumes and Adiabatic Compressibilities of Transfer of Glycine and DL-Alanine from Water to Aqueous Sodium Sulphate at 288.15, 298.15 and 308.15 K." (Journal of Chemical Society Faraday Transaction, 1997, 93, 243-247)


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Last Updated on Friday, 23 June 2017 07:52