Y. Ruiz-Morales

发表

I. Gutman, Y. Ruiz-Morales, 2007 .

Advances in Asphaltene Science and the Yen–Mullins Model

R. Zare, R. Leblanc, O. Mullins, 2012 .

Island versus Archipelago Architecture for Asphaltenes: Polycyclic Aromatic Hydrocarbon Dimer Theoretical Studies

Y. Ruiz-Morales, F. Alvarez-Ramírez, 2013 .

Determination of 13C NMR Chemical Shift Structural Ranges for Polycyclic Aromatic Hydrocarbons (PAHs) and PAHs in Asphaltenes: An Experimental and Theoretical Density Functional Theory Study

J. M. Domínguez, Y. Ruiz-Morales, B. Portales-Martínez, 2019, Energy & Fuels.

The Helicenes: Potential Carriers of Diffuse Interstellar Bands

Y. Ruiz-Morales, F. Alvarez-Ramírez, Jorge O. Oña-Ruales, 2021 .

The calculation of 77Se chemical shifts using gauge including atomic orbitals and density functional theory

G. Schreckenbach, Y. Ruiz-Morales, T. Ziegler, 1996 .

Application of the Y-Rule and Theoretical Study to Understand the Topological and Electronic Structures of Polycyclic Aromatic Hydrocarbons from Atomic Force Microscopy Images of Soot, Coal Asphaltenes, and Petroleum Asphaltenes

Y. Ruiz-Morales, 2022, Energy & Fuels.

Theoretical Study of 13C and 17O NMR Shielding Tensors in Transition Metal Carbonyls Based on Density Functional Theory and Gauge-Including Atomic Orbitals

Y. Ruiz-Morales, T. Ziegler, A. Schreckenbach, 1996 .

Origin of the Hydridic 1H NMR Chemical Shift in Low-Valent Transition-Metal Hydrides

G. Schreckenbach, Y. Ruiz-Morales, T. Ziegler, 1996 .

Dissociating energies, vibrational frequencies and 13C NMR chemical shifts of the 18 electron species [M(CO)6]n (M=Hf-Ir, Mo, Tc, Ru, Cr, Mn, Fe). A density functional study.

E. Baerends, Y. Ruiz-Morales, T. Ziegler, 1997 .

A THEORETICAL STUDY OF 31P AND 95MO NMR CHEMICAL SHIFTS IN M(CO)5PR3 (M = CR, MO; R = H, CH3, C6H5, F, AND CL) BASED ON DENSITY FUNCTIONAL THEORY AND GAUGE-INCLUDING ATOMIC ORBITALS

Y. Ruiz-Morales, T. Ziegler, 1998 .

Coarse-Grained Molecular Simulations to Investigate Asphaltenes at the Oil–Water Interface

O. Mullins, Y. Ruiz-Morales, 2015 .

Mesoscale Dissipative Particle Dynamics to Investigate Oil Asphaltenes and Sodium Naphthenates at the Oil−Water Interface

Y. Ruiz-Morales, F. Alvarez-Ramírez, 2021 .

Prediction of the Ultraviolet–Visible Absorption Spectra of Polycyclic Aromatic Hydrocarbons (Dibenzo and Naphtho) Derivatives of Fluoranthene

Y. Ruiz-Morales, Jorge O. Oña-Ruales, 2017, Applied spectroscopy.

Calculation of125Te Chemical Shifts Using Gauge-Including Atomic Orbitals and Density Functional Theory

Yosadara Ruiz-Morales, Georg Schreckenbach, Tom Ziegler, 1997 .

Molecular Orbital Calculations and Optical Transitions of PAHs and Asphaltenes

Y. Ruiz-Morales, 2007 .

Experimental and Theoretical Approach To Determine the Average Asphaltene Structure of a Crude Oil from the Golden Lane (Faja de Oro) of Mexico

J. Domínguez, Y. Ruiz-Morales, B. Portales-Martínez, 2020, Energy & Fuels.

Advanced Reservoir Evaluation Using Downhole Fluid Analysis and Asphaltene Flory-Huggins-Zuo Equation of State

O. Mullins, Y. Ruiz-Morales, J. Zuo, 2013 .

Singlet–Triplet and Triplet–Triplet Transitions of Asphaltene PAHs by Molecular Orbital Calculations

O. Mullins, Y. Ruiz-Morales, 2013 .

Electronic Absorption Edge of Crude Oils and Asphaltenes Analyzed by Molecular Orbital Calculations with Optical Spectroscopy

O. Mullins, Y. Ruiz-Morales, Xu Wu, 2007 .

HOMO−LUMO Gap as an Index of Molecular Size and Structure for Polycyclic Aromatic Hydrocarbons (PAHs) and Asphaltenes: A Theoretical Study. I

Yosadara Ruiz-Morales, Y. Ruiz-Morales, 2002 .

Triplet Electronic Spin States of Crude Oils and Asphaltenes

O. Mullins, Y. Ruiz-Morales, R. Lepkowicz, 2011 .

Calculation of the Interaction Potential Curve between Asphaltene−Asphaltene, Asphaltene−Resin, and Resin−Resin Systems Using Density Functional Theory

Y. Ruiz-Morales, F. Alvarez-Ramírez, A. Ramirez-Jaramillo, 2006 .

Aromaticity in pericondensed cyclopenta-fused polycyclic aromatic hydrocarbons determined by density functional theory nucleus-independent chemical shifts and the Y-rule — Implications in oil asphaltene stability

Y. Ruiz-Morales, 2009 .

Identification and quantification of seven fused aromatic rings C26H14 peri-condensed benzenoid polycyclic aromatic hydrocarbons in a complex mixture of polycyclic aromatic hydrocarbons from coal tar.

S. Wise, Y. Ruiz-Morales, Jorge O. Oña-Ruales, 2016, Journal of chromatography. A.

The Predictive Power of the Annellation Theory: The Case of the C26H16 Cata-Condensed Benzenoid Polycyclic Aromatic Hydrocarbons.

Y. Ruiz-Morales, Jorge O. Oña-Ruales, 2015, The journal of physical chemistry. A.

The predictive power of the annellation theory: the case of the C32H16 benzenoid polycyclic aromatic hydrocarbons.

Y. Ruiz-Morales, Jorge O. Oña-Ruales, 2014, The journal of physical chemistry. A.

Ab Initio Molecular Dynamics Calculations of the Phase Transformation Mechanism for the Formation of TiO2 Titanate-Type Nanosheets from Anatase

Y. Ruiz-Morales, F. Alvarez-Ramírez, 2007 .

Database of Nuclear Independent Chemical Shifts (NICS) versus NICSZZ of Polycyclic Aromatic Hydrocarbons (PAHs)

Fernando Alvarez-Ramirez, Yosadara Ruiz-Morales, Y. Ruiz-Morales, 2019, J. Chem. Inf. Model..

Measured and Simulated Electronic Absorption and Emission Spectra of Asphaltenes

O. Mullins, Y. Ruiz-Morales, 2009 .

The Agreement between Clar Structures and Nucleus-Independent Chemical Shift Values in Pericondensed Benzenoid Polycyclic Aromatic Hydrocarbons: An Application of the Y-Rule

Yosadara Ruiz-Morales, Y. Ruiz-Morales, 2004 .

Coarse-Grain Molecular Dynamics Simulations To Investigate the Bulk Viscosity and Critical Micelle Concentration of the Ionic Surfactant Sodium Dodecyl Sulfate (SDS) in Aqueous Solution.

Y. Ruiz-Morales, Ascención Romero-Martínez, A. Romero-Martínez, 2018, The journal of physical chemistry. B.

The Influence of Aromaticity in Gas Chromatography Retention: The Case of Polycyclic Aromatic Sulfur Heterocycles

S. Wise, Y. Ruiz-Morales, F. Alvarez-Ramírez, 2018, Chromatographia.

Extended Y-rule method for the characterization of the aromatic sextets in cata-condensed polycyclic aromatic hydrocarbons.

Y. Ruiz-Morales, Jorge O. Oña-Ruales, 2014, The journal of physical chemistry. A.

Polycyclic Aromatic Hydrocarbons of Asphaltenes Analyzed by Molecular Orbital Calculations with Optical Spectroscopy

O. Mullins, Y. Ruiz-Morales, 2007 .

Evaluation of Molecular Fragmentation in Polycyclic Aromatic Hydrocarbons by Time-of-Flight Secondary Ion Mass Spectrometry

O. Mullins, Y. Ruiz-Morales, P. Sjövall, 2023, Energy & Fuels.