13 research outputs found

    Periodic trends and easy estimation of relative stabilities in 11-vertex nido-p-block-heteroboranes and -borates

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    Density functional theory computations were carried out for 11-vertex nido-p-block-hetero(carba)boranes and -borates containing silicon, germanium, tin, arsenic, antimony, sulfur, selenium and tellurium heteroatoms. A set of quantitative values called “estimated energy penalties” was derived by comparing the energies of two reference structures that differ with respect to one structural feature only. These energy penalties behave additively, i.e., they allow us to reproduce the DFT-computed relative stabilities of 11-vertex nido-heteroboranes in general with good accuracy and to predict the thermodynamic stabilities of unknown structures easily. Energy penalties for neighboring heteroatoms (HetHet and HetHet′) decrease down the group and increase along the period (indirectly proportional to covalent radii). Energy penalties for a five- rather than four-coordinate heteroatom, [Het5k(1) and Het5k(2)], generally, increase down group 14 but decrease down group 16, while there are mixed trends for group 15 heteroatoms. The sum of HetHet′ energy penalties results in different but easily predictable open-face heteroatom positions in the thermodynamically most stable mixed heterocarbaboranes and -borates with more than two heteroatoms

    Response and recovery of grapevine to water deficit : from genes to physiology

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    International audienceGrapevine is a crop of global economic importance which is often cultivated in dry Mediterranean climates. In the context of climatic change, periods of drought could increase and become more intense. Growers will face increasing pressure to increase irrigation efficiently and/or adopt new grapevine varieties with increased drought resistance and water use efficiency. Adapting viticulture to these challenges requires an improved understanding of how grapevines behave under drought to enable sustainable management strategies and develop new varieties and rootstocks. This chapter summarizes our current understanding of the changes in physiology, signaling, metabolism, and gene expression that mediate grapevine’s response and adaptation to drought
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