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<!DOCTYPE html>
<html lang="en">
<head>
<meta charset="utf-8">
<meta http-equiv="X-UA-Compatible" content="IE=edge">
<meta name="viewport" content="width=device-width, initial-scale=1.0">
<title>Daniel Castillo Castro — Computational Physicist</title>
<meta content="index,follow" name="robots">
<meta name="description" content="PhD in Physics (Universidad Mayor, Chile) and researcher in multiscale modeling of nanomaterials and quantum computing applied to molecular chemistry."/>
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<meta property="og:title" content="Daniel Castillo Castro — Computational Physicist" />
<meta property="og:description" content="PhD in Physics, researcher in computational nanomaterials and quantum computing. Santiago, Chile." />
<meta property="og:url" content="https://dacastillo.github.io/eng.html" />
<meta property="og:site_name" content="Daniel Castillo Castro" />
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<meta name="twitter:description" content="PhD in Physics, researcher in computational nanomaterials and quantum computing applied to molecular chemistry." />
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"alumniOf": "Universidad Mayor, Chile",
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gtag('js', new Date());
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</script>
</head>
<body>
<!-- Navigation -->
<header class="container">
<nav class="site-nav">
<a href="index.html" class="nav-logo" aria-label="Home">DC</a>
<ul>
<li><a href="man.html">Manifesto</a></li>
<li><a href="cv.html">CV</a></li>
<li><a href="pro.html">Projects</a></li>
<li><a href="link.html">Links</a></li>
<li><a href="index.html" class="nav-lang" aria-label="Versión en español">ES</a></li>
<li><a href="pt.html" class="nav-lang" aria-label="Versão em português">PT</a></li>
</ul>
</nav>
</header>
<!-- Main Content -->
<main class="container">
<!-- Hero Section -->
<section class="hero">
<div class="hero-text">
<h1>Daniel Castillo Castro</h1>
<p class="hero-title">PhD in Physics · Computational Nanomaterials Researcher</p>
<p class="hero-bio">
I work on multiscale modeling of 2D materials at the intersection of
computational simulation, machine-learning interatomic potentials, and
quantum computing applied to molecular chemistry. Member of the Moleqlas
group (QuDIT, PUC Chile).
</p>
<!-- Academic Badges -->
<div class="hero-badges">
<a href="https://orcid.org/0000-0002-9556-4831"
class="badge-link" target="_blank" rel="noopener noreferrer"
title="ORCID: 0000-0002-9556-4831">
<img src="https://img.shields.io/badge/ORCID-0000--0002--9556--4831-brightgreen?style=flat&logo=orcid"
alt="ORCID" loading="lazy" height="20">
</a>
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class="badge-link" target="_blank" rel="noopener noreferrer"
title="GitHub">
<img src="https://img.shields.io/badge/GitHub-Dacastillo-181717?style=flat&logo=github"
alt="GitHub" loading="lazy" height="20">
</a>
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class="badge-link" target="_blank" rel="noopener noreferrer"
title="LinkedIn">
<img src="https://img.shields.io/badge/LinkedIn-esdacastillo-0077B5?style=flat&logo=linkedin"
alt="LinkedIn" loading="lazy" height="20">
</a>
</div>
</div>
<!-- Profile Photo -->
<div class="hero-photo">
<img src="assets/img/profile.jpg" alt="Daniel Castillo Castro" width="140" height="140" loading="eager" onerror="this.style.display='none'">
</div>
</section>
<!-- Featured Projects -->
<section>
<h2>Featured Projects</h2>
<div class="project-grid">
<article class="project-card">
<div class="project-header">
<h3 class="project-title">
<a href="https://github.com/Dacastillo/r" target="_blank" rel="noopener noreferrer">r</a>
</h3>
<span class="project-year">2024–2026</span>
</div>
<p class="project-description">
Computational research in DFT, LAMMPS and molecular dynamics of 2D materials and heterostructures.
</p>
<div class="project-stack">
<code>Python</code>
<code>LAMMPS</code>
<code>DFT</code>
</div>
</article>
<article class="project-card">
<div class="project-header">
<h3 class="project-title">
<a href="https://github.com/Dacastillo/Moleqlas---group-repo" target="_blank" rel="noopener noreferrer">Moleqlas</a>
</h3>
<span class="project-year">2024–2026</span>
</div>
<p class="project-description">
Quantum computing applied to molecular chemistry. Quantum simulations for molecular systems (QuDIT, PUC Chile).
</p>
<div class="project-stack">
<code>Qiskit</code>
<code>Python</code>
<code>VQE</code>
</div>
</article>
<article class="project-card">
<div class="project-header">
<h3 class="project-title">
<a href="https://github.com/Dacastillo/QQuipu3" target="_blank" rel="noopener noreferrer">QQuipu3</a>
</h3>
<span class="project-year">2024</span>
</div>
<p class="project-description">
Simulation of thermal/Gibbs states with quantum circuits. Preparation of state ρ<sub>β</sub> = e<sup>−βH</sup>/Z.
</p>
<div class="project-stack">
<code>Qiskit</code>
<code>Python</code>
</div>
</article>
<article class="project-card">
<div class="project-header">
<h3 class="project-title">
<a href="https://github.com/Dacastillo/Shore-Test" target="_blank" rel="noopener noreferrer">Shore-Test</a>
</h3>
<span class="project-year">2023</span>
</div>
<p class="project-description">
CoastSat applied to Chilean coastlines: Landsat/Sentinel-2 + Google Earth Engine for shoreline tracking.
</p>
<div class="project-stack">
<code>Python</code>
<code>GEE</code>
<code>Sentinel-2</code>
</div>
</article>
<article class="project-card">
<div class="project-header">
<h3 class="project-title">
<a href="https://github.com/Dacastillo/PDE-Test" target="_blank" rel="noopener noreferrer">PDE-Test</a>
</h3>
<span class="project-year">2023</span>
</div>
<p class="project-description">
Solving PDEs with finite elements on 3D geometries defined by STL files.
</p>
<div class="project-stack">
<code>Python</code>
<code>FEM</code>
</div>
</article>
<article class="project-card">
<div class="project-header">
<h3 class="project-title">
<a href="https://github.com/Dacastillo/LAMMPS-tutorial" target="_blank" rel="noopener noreferrer">LAMMPS Tutorial</a>
</h3>
<span class="project-year">2025</span>
</div>
<p class="project-description">
LAMMPS tutorial presented at LAMMPS Workshop. Practical guide for molecular dynamics simulation.
</p>
<div class="project-stack">
<code>LAMMPS</code>
<code>Shell</code>
</div>
</article>
</div>
<p class="mt-lg">
<a href="pro.html">View all projects →</a>
</p>
</section>
<!-- Expertise Areas -->
<section>
<h2>Expertise Areas</h2>
<div class="project-grid">
<article class="project-card">
<h3 class="project-title">Computational Simulation</h3>
<p class="project-description">
Molecular dynamics with LAMMPS, DFT with GPAW/Quantum ESPRESSO/ORCA, multiscale modeling of 2D materials.
</p>
<div class="project-stack">
<code>LAMMPS</code>
<code>GPAW</code>
<code>QE</code>
<code>ORCA</code>
</div>
</article>
<article class="project-card">
<h3 class="project-title">Machine Learning</h3>
<p class="project-description">
Machine-learning interatomic potentials (MLIP, Behler-Parrinello), active learning, AMP.
</p>
<div class="project-stack">
<code>PyTorch</code>
<code>AMP</code>
<code>scikit-learn</code>
</div>
</article>
<article class="project-card">
<h3 class="project-title">Quantum Computing</h3>
<p class="project-description">
VQE, compact ansätze, Gibbs states, quantum chemistry in Qiskit.
</p>
<div class="project-stack">
<code>Qiskit</code>
<code>VQE</code>
<code>Python</code>
</div>
</article>
<article class="project-card">
<h3 class="project-title">Bibliometric Analysis</h3>
<p class="project-description">
R-based system for scientific literature analysis with OpenAlex, Semantic Scholar, CrossRef.
</p>
<div class="project-stack">
<code>R</code>
<code>openalexR</code>
<code>bibliometrix</code>
</div>
</article>
</div>
</section>
</main>
<!-- Footer -->
<footer class="container">
<div class="site-footer">
<div class="footer-location">Santiago, Chile</div>
<div class="footer-links">
<a href="https://github.com/Dacastillo" target="_blank" rel="noopener noreferrer">GitHub</a>
<a href="https://www.linkedin.com/in/esdacastillo/" target="_blank" rel="noopener noreferrer">LinkedIn</a>
<a href="https://orcid.org/0000-0002-9556-4831" target="_blank" rel="noopener noreferrer">ORCID</a>
<a href="https://www.instagram.com/castillocastro_/" target="_blank" rel="noopener noreferrer">Instagram</a>
<a href="https://chilemasto.casa/@dacastillo" target="_blank" rel="noopener noreferrer">Mastodon</a>
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<div class="footer-copy">© 2018–2026 Daniel Castillo Castro</div>
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