Ab Initio Calculations - Articles - Scientific Research Publishing

Circular Scale of Time as a Guide for the Schrödinger Perturbation Process of a Quantum-Mechanical System (Articles)

Stanisław Olszewski

World Journal of Mechanics Vol.9 No.5, May 16, 2019

DOI: 10.4236/wjm.2019.95009 786 Downloads 2,028 Views Citations
A Thematic Analysis on Vedic Mathematics and Its Importance (Articles)

Sher Singh Raikhola, Dinesh Panthi, Eka Ratna Acharya, Kanhaiya Jha

Open Access Library Journal Vol.7 No.8, August 28, 2020

DOI: 10.4236/oalib.1106665 1,803 Downloads 10,122 Views Citations
Key Role of Some Specific Occupied Molecular Orbitals of Short Chain n-Alkanes in Their Surface Tension and Reaction Rate Constants with Hydroxyl Radicals: DFT Study (Articles)

Mikhail Yu Gorbachev, Natalia N. Gorinchoy, Ion Arsene

International Journal of Organic Chemistry Vol.11 No.1, January 29, 2021

DOI: 10.4236/ijoc.2021.111001 739 Downloads 1,964 Views Citations
Multi-Energy Gamma-Ray Attenuations for Non-Destructive Detection of Hazardous Materials (Articles)

Kaylyn Olshanoski, Chary Rangacharyulu

Journal of Modern Physics Vol.13 No.1, January 26, 2022

DOI: 10.4236/jmp.2022.131005 361 Downloads 1,716 Views Citations
Molecular Orbital Nature of Solubility of Shot Chain n-Alkanes in Water and Their Reaction Rate Constants with Nitronium Cations: A DFT Study (Articles)

Mikhail Yu. Gorbachev, Natalia N. Gorinchoy

International Journal of Organic Chemistry Vol.12 No.2, June 9, 2022

DOI: 10.4236/ijoc.2022.122008 349 Downloads 1,302 Views Citations
Dating the Birth of Jesus Christ on Hanukkah (Articles)

Liberato De Caro, Fernando La Greca, Emilio Matricciani

Open Journal of Social Sciences Vol.10 No.10, September 26, 2022

DOI: 10.4236/jss.2022.1010020 417 Downloads 45,485 Views Citations
Electronic Aspects of the Synergistic Antioxidant Interaction of Various Pairs “Phenolic Food Acid and Glutathione” in Their Reactions with the Stable Radical Cation ABTS^+· (Articles)

Mikhail Yu. Gorbachev, Natalia N. Gorinchoy, Iolanta I. Balan

International Journal of Organic Chemistry Vol.13 No.3, September 26, 2023

DOI: 10.4236/ijoc.2023.133008 334 Downloads 1,214 Views Citations
Increasing the Contribution of Specially Protected Natural Areas to the Socio-Economic Development of Regions (Articles)

Shevchuk Anatoly Vasilyevich

Open Journal of Social Sciences Vol.13 No.5, May 30, 2025

DOI: 10.4236/jss.2025.135034 83 Downloads 441 Views Citations
Electronic Structure with Rovibrationl and Dipole Moment Study of the NiO Molecule (Articles)

Khalil Badreddine, Nayla El-Kork, Mahmoud Korek

Journal of Modern Physics Vol.3 No.8, August 16, 2012

DOI: 10.4236/jmp.2012.38110 4,305 Downloads 7,683 Views Citations
Theoretical Study with Rovibrational and Dipole Moment Calculation of the SiO Molecule (Articles)

Khalil Badreddine, Nayla El-Kork, Mahmoud Korek

Journal of Modern Physics Vol.4 No.1, January 28, 2013

DOI: 10.4236/jmp.2013.41014 4,043 Downloads 7,773 Views Citations
Electronic Structure and Spectroscopic Studies of the Molecule ScS (Articles)

Rawad Halabi, Mahmoud Korek

Journal of Modern Physics Vol.6 No.5, April 9, 2015

DOI: 10.4236/jmp.2015.65059 3,337 Downloads 4,617 Views Citations
Theoretical Calculation of the Low-Lying Electronic States of the Molecule BaS (Articles)

Sally Shawa, Mahmoud Korek, Ghassan Younes, Nayla El-Kork

Journal of Modern Physics Vol.6 No.5, April 16, 2015

DOI: 10.4236/jmp.2015.65066 3,649 Downloads 4,986 Views Citations
Theoretical Calculation of the Low-Lying Electronic States of the Molecule PbO (Articles)

Diana Kaeen, Mahmoud Korek, Saleh Nabhan Abdulal, Ramadan Awad

Journal of Modern Physics Vol.6 No.8, July 30, 2015

DOI: 10.4236/jmp.2015.68121 2,890 Downloads 4,182 Views Citations
Impact of Heat Treatments and Hole Density (p) on the Structural, Electrical, and Superconducting Properties of LnSrBaCu₃O_6+z (Ln = Eu, Sm, Nd) Compounds (Articles)

Mohammed Bellioua, Mohamed Id El Amel, Fatima Bouzit, Mohamed Errai, Driss Soubane, Aderrahim Ait Khlifa, Mohammed Khenfouch, Issam Mouhti, Ahmed Tirbiyine, Essediq Youssef El Yakoubi, Abdelhakim Nafidi

Communications and Network Vol.15 No.4, September 27, 2023

DOI: 10.4236/cn.2023.154006 309 Downloads 1,250 Views Citations
Modified Atomic Orbital Calculations of Energy of the (2s² ¹S) Ground-State, the (2p² ¹D); (3d² ¹D) and (4f² ¹I) Doubly Excited States of Helium Isoelectronic Sequence from H^- to Ca¹⁸⁺ (Articles)

Malick Sow, Ibrahima Sakho, Boubacar Sow, Abdou Diouf, Youssou Gning, Babou Diop, Matabara Dieng, Abdourahmane Diallo, Mamadou Diouldé Ba, Jean Kouhissoré Badiane, Mamadi Biaye, Ahmadou Wagué

Journal of Applied Mathematics and Physics Vol.8 No.1, January 6, 2020

DOI: 10.4236/jamp.2020.81007 904 Downloads 2,245 Views Citations
Energy Positions of the ^1,3D^e Rydberg Series of the He-Like Ions Up to the N = 9 Threshold (Articles)

Matabara Dieng, Babou Diop, Malick Sow, Youssou Gning, Mamadi Biaye, Ababacar Sadikhe Ndao, Ahmadou Wagué

Journal of Applied Mathematics and Physics Vol.8 No.8, August 20, 2020

DOI: 10.4236/jamp.2020.88119 498 Downloads 1,399 Views Citations
Preclinical Verification of Modulated Electro-Hyperthermia
—Part I. In Vitro Research (Articles)

Andras Szasz

International Journal of Clinical Medicine Vol.15 No.7, July 29, 2024

DOI: 10.4236/ijcm.2024.157019 193 Downloads 896 Views Citations
A Computational Evaluation of Bond Order and Charge Distributions in Isomeric Aminotroponiminiums and Their Benzo-Fused Derivatives (Articles)

S. N. Balasubrahmanyam, Irishi N. Namboothiri, Kuruvilla Pius

Open Journal of Physical Chemistry Vol.2 No.1, February 27, 2012

DOI: 10.4236/ojpc.2012.21003 4,352 Downloads 8,080 Views Citations
¹³C-¹⁸O Bonds in Precipitated Calcite and Aragonite: An ab Initio Study (Articles)

Jie Yuan, Zhigang Zhang, Yigang Zhang

Open Journal of Geology Vol.4 No.9, September 26, 2014

DOI: 10.4236/ojg.2014.49034 3,076 Downloads 4,494 Views Citations
Influence of Mg²⁺, Fe²⁺ and Zn²⁺ Cations on ¹³C-¹⁸O Bonds in Precipitated Aragonite, Calcite and Dolomite: An ab Initio Study (Articles)

Jie Yuan

Open Journal of Geology Vol.5 No.5, May 11, 2015

DOI: 10.4236/ojg.2015.55023 5,450 Downloads 6,879 Views Citations

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