Publicaciones
Publicaciones agradeciendo al NLHPC por el aporte con capacidad de cómputo a sus proyectos de investigación.
Theoretical investigation of electronic and optical properties of the 2D-MoSe2/GaN heterostructure nanosheet Artículo de revista
En: Physica E: Low-dimensional Systems and Nanostructures, vol. 135, pp. 114994, 2022.
Nanoindentation of nanoporous tungsten: A molecular dynamics approach Artículo de revista
En: Computational Materials Science, vol. 209, pp. 111336, 2022.
Probing the Mechanical Properties of Porous Nanoshells by Nanoindentation Artículo de revista
En: Nanomaterials, vol. 12, no 12, pp. 2000, 2022.
Simulations of plasticity in diamond nanoparticles showing ultrahigh strength Artículo de revista
En: Diamond and Related Materials, vol. 126, pp. 109109, 2022.
Enhancing the magnetic response on polycrystalline nanoframes through mechanical deformation Artículo de revista
En: Scientific Reports, vol. 12, no 1, 2022.
Species Content Effect on the Rejuvenation Degree of CuZr Metallic Glasses Under Thermal-Pressure Treatments Artículo de revista
En: Metals and Materials International, vol. 28, no 9, pp. 2068–2074, 2022.
Enhancing the Thermal Conductivity of Amorphous Carbon with Nanowires and Nanotubes Artículo de revista
En: Nanomaterials, vol. 12, no 16, pp. 2835, 2022.
Training and intrinsic evaluation of lightweight word embeddings for the clinical domain in Spanish Artículo de revista
En: Frontiers in Artificial Intelligence, vol. 5, 2022.
Open Sea Lab: An integrated Coastal Ocean Observatory Powered by Wave Energy Artículo de revista
En: Journal of Marine Science and Engineering, vol. 10, no 9, pp. 1249, 2022.
Modelling geographical and built-environment attributes as predictors of human vulnerability during tsunami evacuations: a multi-case-study and paths to improvement Artículo de revista
En: Natural Hazards and Earth System Sciences, vol. 22, no 9, pp. 2857–2878, 2022.
Xanthatin and 8-epi-xanthatin as new potential colchicine binding site inhibitors: a computational study Artículo de revista
En: 2022.
Computational modeling of a PV-PCM passive cooling system during a day–night cycle at arid and semi-arid climate zones Artículo de revista
En: Energy Conversion and Management, vol. 270, pp. 116202, 2022.
Exploring the translocation mechanism of a hydrophobic penetrating peptide Artículo de revista
En: 2022.
Revisiting viscous transonic decretion disks of Be stars Artículo de revista
En: Astronomy &$mathsemicolon$ Astrophysics, vol. 664, pp. A185, 2022.
A portable smart detection and electrocatalytic mechanism of mycophenolic acid: A machine learning-based electrochemical nanosensor to adapt variable-pH silage microenvironment Artículo de revista
En: Sensors and Actuators B: Chemical, vol. 372, pp. 132627, 2022.
An In Vitro and In Silico Study of Antioxidant Properties of Curcuminoid N-alkylpyridinium Salts: Initial Assessment of Their Antitumoral Properties Artículo de revista
En: Antioxidants, vol. 11, no 6, pp. 1104, 2022.
From an antiferromagnetic insulator to a strongly correlated metal in square-lattice MCl2(pyrazine)2 coordination solids Artículo de revista
En: Nature Communications, vol. 13, no 1, 2022.
Research on metallic glasses at the atomic scale: a systematic review Artículo de revista
En: SN Applied Sciences, vol. 4, no 10, 2022.
Scrutinizing the mechanism of CO2 hydrogenation over Ni, CO and bimetallic NiCo surfaces: Isotopic measurements, operando-FTIR experiments and kinetics modelling Artículo de revista
En: Journal of Catalysis, vol. 414, pp. 1–15, 2022.
Tuning the visible-NIR absorption of azulenocyanine-based photosensitizers Artículo de revista
En: Journal of Molecular Modeling, vol. 28, no 11, 2022.
En: Molecular Systems Design &$mathsemicolon$ Engineering, 2022.
BH4Ng$mathplus$ (Ar–Rn): Viable Compounds with a B-Ng Covalent Bond Artículo de revista
En: ChemPhysChem, 2022.
Synthesis, Structural, and Intriguing Electronic Properties of Symmetrical Bis-Aryl-$upalpha$, $upbeta$-Unsaturated Ketone Derivatives Artículo de revista
En: ACS Omega, 2022.
Flavonoids improve the stability and function of $łess$scp$greater$P23H$łess$/scp$greater$ rhodopsin slowing down the progression of retinitis pigmentosa in mice Artículo de revista
En: Journal of Neuroscience Research, vol. 100, no 4, pp. 1063–1083, 2022.
Studying noncovalent or covalent bond problem between smoothened and cholesterol by molecular dynamics simulation and Markov state model Artículo de revista
En: Physical Chemistry Chemical Physics, vol. 24, no 32, pp. 19564–19575, 2022.
Models of bed-load transport across scales: turbulence signature from grain motion to sediment flux Artículo de revista
En: Stochastic Environmental Research and Risk Assessment, 2022.
E6C15 (E = Si-Pb): Polycyclic Aromatic Compounds with Three planar Tetracoordinate Carbons Artículo de revista
En: Chemical Communications, 2022.
A New Methodology for Source Apportionment of Gaseous Industrial Emissions Artículo de revista
En: Journal of Hazardous Materials, pp. 130335, 2022.
Atomistic simulations of tensile deformation of a nanoporous high-entropy alloy Artículo de revista
En: Journal of Materials Science, 2022.
BrumiR: A toolkit for $łess$i$greater$de novo$łess$/i$greater$ discovery of microRNAs from sRNA-seq data Artículo de revista
En: GigaScience, vol. 11, 2022.
Is IIIG9 a New Protein with Exclusive Ciliary Function? Analysis of Its Potential Role in Cancer and Other Pathologies Artículo de revista
En: Cells, vol. 11, no 20, pp. 3327, 2022.
Packing of inhibitor molecules during area-selective atomic layer deposition studied using random sequential adsorption simulations Artículo de revista
En: Journal of Vacuum Science &$mathsemicolon$ Technology A, vol. 40, no 6, pp. 062409, 2022.
Extending the $uppi$-system of inverted solvatochromic phenolate-based dyes shifts their inversion point due to an increment in their sensitivity to solvent polarizability Artículo de revista
En: Journal of Molecular Liquids, pp. 120784, 2022.
Hidden Intermediate Activation: A Concept to Elucidate the Reaction Mechanism of the Schmittel Cyclization of Enyne-Allenes Artículo de revista
En: Physical Chemistry Chemical Physics, 2022.
Natural Variation in Diauxic Shift between Patagonian $łess$i$greater$Saccharomyces eubayanus$łess$/i$greater$ Strains Artículo de revista
En: 2022.
Nature and Role of Formal Charge of the ion Inclusion in Hexanuclear Platinium(II) Host-Guest Species. Insights from Relativistic DFT Calculations Artículo de revista
En: Inorganica Chimica Acta, pp. 121298, 2022.
Insights into the equilibrium structure and translocation mechanism of TP1, a spontaneous membrane-translocating peptide Artículo de revista
En: Scientific Reports, vol. 12, no 1, 2022.
ANTIAGE-DB: A Database and Server for the Prediction of Anti-Aging Compounds Targeting Elastase, Hyaluronidase, and Tyrosinase Artículo de revista
En: Antioxidants, vol. 11, no 11, pp. 2268, 2022.
Product line optimization with multiples sites Artículo de revista
En: Computers &$mathsemicolon$ Operations Research, vol. 148, pp. 105978, 2022.
Carvacrol and HP-$upbeta$-Cyclodextrin Complexes: Extensive Characterization and Potential Cytotoxic Effect in Human Colorectal Carcinoma Cells Artículo de revista
En: Pharmaceutics, vol. 14, no 12, pp. 2638, 2022.
Genomic Evidence Suggests Viral Persistence of SARS-CoV-2 for 386 Days in Health Worker: A Case Report from Santiago of Chile Artículo de revista
En: Infectious Disease Reports, vol. 14, no 6, pp. 971–978, 2022.
Into the Role of Unsaturated Trinuclear Metal Carbonyls in the Formation of [M3(2, 3-bpp)(CO)10] with M=Ru, Os: A DFT Stability Analysis and Electronic Structure Artículo de revista
En: Journal of Cluster Science, 2022.
A large diffusion and small amplification dynamics for density classification on graphs Artículo de revista
En: International Journal of Modern Physics C, 2022.
Toward Fractal Development of Data Processing-Intensive Artificial Intelligence Systems Artículo de revista
En: IEEE Software, vol. 39, no 6, pp. 28–34, 2022.
Merging dual photoredox/cobalt catalysis and boronic acid (derivatives) activation for the Minisci reaction Artículo de revista
En: Organic Chemistry Frontiers, 2022.
Statistical inference for unreliable grading using the maximum entropy principle Artículo de revista
En: Chaos: An Interdisciplinary Journal of Nonlinear Science, vol. 32, no 12, pp. 123103, 2022.
annotate_my_genomes: an easy-to-use pipeline to improve genome annotation and uncover neglected genes by hybrid RNA sequencing Artículo de revista
En: GigaScience, vol. 11, 2022.
Distributed maximal independent set computation driven by finite-state dynamics Artículo de revista
En: International Journal of Parallel, Emergent and Distributed Systems, pp. 1–13, 2022.
Impacts of subgrid temperature distribution along elevation bands in snowpack modeling: Insights from a suite of Andean catchments Artículo de revista
En: Water Resources Research, 2022.
Effects of Site Geometry and Local Composition on Hydrogenation of Surface Carbon to Methane on Ni, Co, and NiCo Catalysts Artículo de revista
En: Catalysts, vol. 12, no 11, pp. 1380, 2022.
New processing methodology to incorporate marine halocarbons and dimethyl sulfide (DMS) emissions from the CAMS-GLOB-OCE dataset in air quality modeling studies Artículo de revista
En: Air Quality, Atmosphere &$mathsemicolon$ Health, 2022.
Planar Elongated B12 Structure in M3B12 Clusters (M = Cu-Au) Artículo de revista
En: Molecules, vol. 28, no 1, pp. 236, 2022.
Towards a rational design of natural deep eutectic solvents for the extraction of polyphenols from Luma apiculata Artículo de revista
En: Journal of Molecular Liquids, pp. 121155, 2022.
Towards a rational design of natural deep eutectic solvents for the extraction of polyphenols from Luma apiculata Artículo de revista
En: Journal of Molecular Liquids, pp. 121155, 2022.
Evaluation of Slight Changes in Aromaticity through Electronic and Density Functional Reactivity Theory-Based Descriptors Artículo de revista
En: ACS Omega, vol. 7, no 25, pp. 21939–21945, 2022.
On the optimization of pit stop strategies via dynamic programming Artículo de revista
En: Central European Journal of Operations Research, 2022.
Impacts in ports on a tectonically active coast for climate-driven projections under the RCP 8.5 scenario: 7 Chilean ports under scrutiny Artículo de revista
En: Coastal Engineering Journal, vol. 64, no 3, pp. 387–405, 2022.
Analysis of~Biases in~Calibrated Recommendations Book Section
En: Communications in Computer and Information Science, pp. 91–103, Springer International Publishing, 2022.
DensityTool: A post-processing tool for space- and spin-resolved density of states from VASP Artículo de revista
En: Computer Physics Communications, vol. 277, pp. 108384, 2022.
Equipo
Equipo humano del NLHPC
Socios
Instituciones asociadas al NLHPC