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Facile Synthesis, Crystal Growth, Quantum Chemical Studies of Electronic Structure and OfProfoundly Persuasive Nlo Organic Crystal: Ethyl 4-[N,N-Bis(P-Toluenesulfonyl)]- Aminobenzoate by
  • Mazhar, Sana
  • Khalid, Muhammad
  • Tahir, Muhammad Nawaz
  • Haroon, Muhammad
Source: Journal of Chemical Society of Pakistan
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Phytochemical, Crystal Structure, Spectroscopic, Dft Based Non Covalent Interactions and Non-linear Optical Studies of Neurada Procumbens by
  • Abbas, Mazhar
  • Khalid, Muhammad
  • Ibrahim, Muhammad
  • Tahir, Muhammad Nawaz
Source: Journal of Chemical Society of Pakistan
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Quantum Mechanical Study onMechanistic, Energetic and Structural Aspects of Adsorption of 2-Methoxyestradiol Drug on Functionalized Carbon Nanotube by
  • Arab, Mohammad
  • Morsali, Ali
  • Heravi, Mohammad M
  • Beyramabadi, S. Ali
Source: Journal of Chemical Society of Pakistan
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Synthesis, Crystal Structure, Spectral Analysis, Dft Studies and Antimicrobial Activity of Ethyl 6-(4-(Ethoxycarbonyl)-1h-1,2,3-Triazol-1-Yl)Pyridine-3-Carboxylate by
  • Ahmed, Muhammad Naeem
  • Yasin, Khawaja AnSAR
Source: Journal of Chemical Society of Pakistan
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Molecular Hydrogen Uptake by Zigzag Graphene Nanoribbons Doped with Early 3d Transition-Metal Atoms by
  • Longo, R. C
  • Galiego, L. J
  • Lebon, A
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Assessment of Theoretical Methods for Study of Hydrogen Abstraction Kinetics of Global Warming Gas Species During Their Degradation and byproduct Formation (Iupac Technical Report) by
  • Ramasami, Ponnadurai
  • Abdaliah, Hassan H
  • Shuai, Zhigang
Source: Pure and Applied Chemistry (International Journal of)
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Insights Into Hydrogen Generation from Formic Acid on Ptrubiox in Aqueous Solution at Room Temperature by
  • Hu, Chaoquan
  • Ting, Siu Wa
  • Chan, Kwong Yu
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Energetic and Structural Analysis of N2h4bh3 Inorganic Solid and its Modified Material for Hydrogen Storage by
  • Pathak, Biswarup
  • Qian, Zhao
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
The Optical Absorption and Hydrogen Production by Water Splitting of (Si,Fe)-Codopedanatase Tio2 Photocatalyst by
  • lin, Yanming
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Mgh2 and lih Metal Hydrides Crystals as Novel Hydrogen Storage Material: Electronic Structure and Optical Properties by
  • Reshak, A.H
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Nh3/Ir(100): Electronic Structure and Dehydrogenation by
  • Zhang, Yimin
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Effect of Nitrogen Induced Defects in li Dispersed Graphene on Hydrogen Storage by
  • Lee, Sangho
  • Lee, Minho
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Dynamical Stability OfLanthanum Dihydride Under High Pressure: a Density Functional Lattice Dynamics Approach by
  • Gupta, Sanjeev K
  • Jha, Prafulia K
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Theoretical Study on Porphyrin Based Covalent Organic Polyhedra as a Hydrogen Storage by
  • Kim, Daejin
  • Jung, Dong Hyun
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Confinement Effects on Structural Electronic Properties and Dehydrogenation Thermodynamics of libh4 by
  • liu, Chuan
  • Zhang, Shengli
  • Wang, Peng
  • Huang, Shiping
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Artificial Neural Network Prediction Indicators of Density Functional Theory Metal Hydride Models by
  • Griffin, Wililam O
  • Darsey, Jerry A
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Bowl-To-Bowl Inversion of Sumanene Derivatives by
  • Amaya, Toru
Source: Pure and Applied Chemistry (International Journal of)
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Atomistic Study of Lanbo4; Surface Properties and Hydrogen Adsorption by
  • Hadidi, Khayroliah
  • Hancke, Ragnhild
  • Norby, Truls
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Effects of Nonmetal Element (B, C and Si) Additives in Mg2ni Hydrogen Storage Alioy: a First-Principles Study by
  • Ding, H
  • Zhang, Shengli
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
Reaction Pathways Derived from Dft for Understanding Catalytic Decomposition of Formic Acid Into Hydrogen on Noble Metals by
  • Hu, Chaoquan
  • Ting, Siu-Wa
  • Chan, Kwong-Yu
Source: International Journal of Hydrogen Energy
Material type: Article Article; Format: print
Availability: Items available for loan: Engr Abul Kalam Library (1).
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