American Journal of Quantum Chemistry and Molecular Spectroscopy


Volume 1, Issue 1, December 2017

  • Modern Ab-initio Calculations Based on Tomas-Fermi-Dirac Theory with High-Pressure Environment

    Sergey Seriy

    Issue: Volume 1, Issue 1, December 2017
    Pages: 1-6
    Received: 21 October 2016
    Accepted: 7 November 2016
    Published: 21 December 2016
    DOI: 10.11648/j.ajqcms.20170101.11
    Abstract: Thomas-Fermi theory is an approximate method, which is widely used to describe the properties of matter at various hierarchical levels (atomic nucleus, atom, molecule, solid, etc.). Special development achieved using Thomas-Fermi theory to the theory of extreme states of matter appearing under high pressures, high temperatures or strong external fi... Show More
  • Adsorption on (Ni-H2, Pd-H2, Pt-H2) Metal-Hydrogen Interaction: DFT Approach

    Juan Manuel Larrea Munguía, Juan Horacio Pacheco Sánchez, Federico del Razo López

    Issue: Volume 1, Issue 1, December 2017
    Pages: 7-20
    Received: 23 October 2016
    Accepted: 26 December 2016
    Published: 20 January 2017
    DOI: 10.11648/j.ajqcms.20170101.12
    Abstract: Our aim is to find the kind of adsorption (physisorption or chemisorption) existent, where the interaction of one metal atom (Ni, Pd, Pt) with one hydrogen molecule is achieved for modeling potential energy surface using DFT approach. This molecular modeling is developed when attacking a metal atom with a hydrogen molecule. Attack starts at 10 Å co... Show More
  • Liquid Chromatography – Mass Spectrometry (LC-MS) Analysis of Withania somnifera (Ashwagandha) Root Extract Treated with the Energy of Consciousness

    Mahendra Kumar Trivedi, Alice Branton, Dahryn Trivedi, Gopal Nayak, Cathryn Dawn Nykvist, Celine Lavelle, Daniel Paul Przybylski, Dianne Heather Vincent, Dorothy Felger, Douglas Jay Konersman, Elizabeth Ann Feeney, Jay Anthony Prague, Joanne Lydia Starodub, Karan Rasdan, Karen Mie Strassman, Leonid Soboleff, Maire Anne Mayne, Mary M. Keesee, Padmanabha Narayana Pillai, Pamela Clarkson Ansley, Ronald David Schmitz, Sharyn Marie Sodomora, Kalyan Kumar Sethi, Parthasarathi Panda, Snehasis Jana

    Issue: Volume 1, Issue 1, December 2017
    Pages: 21-30
    Received: 6 February 2017
    Accepted: 27 February 2017
    Published: 21 March 2017
    DOI: 10.11648/j.ajqcms.20170101.13
    Abstract: Withania somnifera (ashwagandha) root extract is very popular ancient herbal medicine. The objective of the study was to characterize and evaluate the impact of The Trivedi Effect®-Biofield Energy Healing Treatment (Energy of Consciousness) on phytoconstituents present in the ashwagandha root extract using LC-MS. Ashwagandha root extract was divide... Show More
  • Evaluation of the Physicochemical, Spectral, Thermal and Behavioral Properties of Sodium Selenate: Influence of the Energy of Consciousness Healing Treatment

    Mahendra Kumar Trivedi, Alice Branton, Dahryn Trivedi, Gopal Nayak, William Dean Plikerd, Peter L. Surguy, Robert John Kock, Rolando Baptista Piedad, Russell Phillip Callas, Sakina A. Ansari, Sandra Lee Barrett, Sara Friedman, Steven Lee Christie, Su-Mei Chen Liu, Susan Elizabeth Starling, Susan Jones, Susan Mardis Allen, Susanne Kathrin Wasmus, Terry Ann Benczik, Thomas Charles Slade, Thomas Orban, Victoria L. Vannes, Victoria Margot Schlosser, Yusif Sarkis Yamin Albino, Kalyan Kumar Sethi, Parthasarathi Panda, Snehasis Jana

    Issue: Volume 1, Issue 1, December 2017
    Pages: 31-40
    Received: 27 February 2017
    Accepted: 2 May 2017
    Published: 8 May 2017
    DOI: 10.11648/j.ajqcms.20170101.14
    Abstract: Sodium selenate is an inorganic nutraceutical/pharmaceutical compound used for the prevention and treatment of several diseases. The current research article was aimed to explore the effect of The Trivedi Effect® - Energy of Consciousness Healing Treatment on the physicochemical, spectral, thermal, and behavioral properties of sodium selenate using... Show More