The electrochemical method of combining N2 and H2O to produce ammonia (ie, the
electrochemical nitrogen reduction reaction [E‐NRR]) continues to draw attention as it is …

Global ammonia production reached 175 million metric tons in 2016, 90% of which is
produced from high purity N2 and H2 gases at high temperatures and pressures via the …

In this contribution to the special software-centered issue, the ORCA program package is
described. We start with a short historical perspective of how the project began and go on to …

As we begin to reach the limits of classical computing, quantum computing has emerged as
a technology that has captured the imagination of the scientific world. While for many years …

During the past decades, the diesel engine has been through times of upheaval, boom and
bust. At the beginning of the century, almost 50% of the new vehicle registrations in the …

NH 3 production is dependent on the century-old Haber-Bosch process, which is energy and
capital intensive and relies on H 2 from steam reforming, hence, contributing to greenhouse …

Nitrogen is an essential element contained in many biomolecules necessary to sustain life.
1, 2 This element is abundantly available in Earth's atmosphere in the form of dinitrogen …

Hydrogen is a renewable energy carrier that is one of the most competent fuel options for the
future. The majority of hydrogen is currently produced from fossil fuels and their derivatives …

Gases like H2, N2, CO2, and CO are increasingly recognized as critical feedstock in “green”
energy conversion and as sources of nitrogen and carbon for the agricultural and chemical …

Ammonia, produced via the Haber-Bosch (HB) process, is globally the leading chemical in
energy consumption and carbon dioxide emissions. In ammonia plants, hydrogen is …