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Despite policymakers deploying various tools to mitigate emissions of ozone (O\textsubscript{3}) precursors, such as nitrogen oxides (NO\textsubscript{x}), carbon monoxide (CO), and volatile organic compounds (VOCs), the effectiveness of…
In this paper, we propose a method to build molecular cages designed to capture a specific substrate. We model a cage as a graph of atoms with coordinates in space, and several constraints on their edges (degree, length and angle). We use a…
Carbon dioxide is one of the major contributors to the radiative forcing, increasing both the temperature and the humidity of Earth's atmosphere. If the stellar irradiance increases and water becomes abundant in the stratosphere of an…
Having in mind as target audience beginner researchers working in the field of cultural heritage, we present succinctly the concept of two-scale modeling of reaction-diffusion problems as it fits to scenarios where the action of the…
We investigate the effect of pressure, temperature and acidity on the composition of water-rich carbon-bearing fluids at thermodynamic conditions that correspond to the Earth's deep Crust and Upper Mantle. Our first-principles molecular…
Estimating health benefits of reducing fossil fuel use from improved air quality provides important rationales for carbon emissions abatement. Simulating pollution concentration is a crucial step of the estimation, but traditional…
Increases in atmospheric CO2 and CH4 result from a combination of forcing from anthropogenic emissions and Earth System feedbacks that reduce or amplify the effects of those emissions on atmospheric concentrations. Despite decades of…
The exploitation of using agro-industrial residues as the cherry stone to produce charcoal and activated carbon is very relevant nowadays due to the high demand of these materials and their environmental advantages. This work describes the…
The stability of Earth's climate on geological timescales is enabled by the carbon-silicate cycle that acts as a negative feedback mechanism stabilizing surface temperatures via the intake and outgas of atmospheric carbon. On Earth, this…
The alteration of the climate in various areas of the world is of increasing concern since climate stability is a necessary condition for human survival as well as every living organism. The main reason of climate change is the greenhouse…
Global warming is seen as a drastic environmental problem nowadays. Carbon dioxide (CO 2 ) concentration in the Earth's atmosphere is linked to the average temperature on the surface of the planet. Carbon capture and storage is an important…
Following the Paris Agreement of $2015$, most countries have agreed to reduce their carbon dioxide (CO$_2$) emissions according to individually set Nationally Determined Contributions. However, national CO$_2$ emissions are reported by…
Direct air capture (DAC) of carbon dioxide is a promising method for mitigating climate change. Solid sorbents, such as metal-organic frameworks, are currently being tested for DAC application. However, their potential for deployment at…
An efficient compositional framework is developed for simulation of CO2 storage in saline aquifers during a full-cycle injection, migration and post-migration processes. Essential trapping mechanisms, including structural, dissolution, and…
We argue that geostationary (GEO) reflective containers filled with $CO_2$ could be used as shading devices to selectively cool areas on Earth's surface. This proposal would be an interesting addition to the recently discussed suggestion of…
Despite well-meaning scenarios that propose global CO2 emissions will decline presented in every IPCC report since 1988, the trend of global CO2 increase continues without significant change. Even if any individual nation manages to flatten…
We study the mitigation of climate tipping point transitions using an energy balance model. The evolution of the global mean surface temperature is coupled with the CO2 concentration through the green house effect. We model the CO2…
Metal Organic Frameworks (MOFs) are promising materials to help mitigate the effects of global warming by selectively absorbing $\text{CO}_{2}$ for direct capture. Accurate quantum chemistry simulations are a useful tool to help select and…
Soil organic carbon (SOC) monitoring often relies on selecting representative field sampling locations based on environmental covariates. We propose a novel hybrid methodology that integrates spectral clustering - an unsupervised machine…
When reactive fluids flow through a dissolving porous medium, conductive channels form, leading to fluid breakthrough. This phenomenon is important in geologic carbon storage, where the dissolution of CO2 in water increases the acidity and…