Spectroscopic (FT-IR and FT-Raman) and quantum chemical study on monomer and dimer of benznidazole from DFT and molecular docking approaches by Tirth Raj Paneru, Manoj Kumar Chaudhary, Poonam Tandon, Bhawani Datt Joshi, Beatriz Pinheiro Bezerra, Alejandro Pedro Ayala

“…A one-dimensional potential energy surface scan was carried out across flexible bonds to find the minimum energy structure. …”
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Design and Development of a Pine Needle Briquetting Machine for the Uttarakhand Region of India by Tejas Pramod Naik, Soumyajeet Jaiswal, Inderdeep Singh, Apurbba Kumar Sharma, Ayush Joshi

“…This forest bio residue is renewable and is a potential energy source for rural livelihoods, which would also generate social business enterprises among the locals. …”
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Gas Displacement Engineering Test by Combination of Low and Medium Pressure Injection with Liquid CO2 in High Gas and Low Permeability Coal Seam by Hu Wen, Mingyang Liu, Gaoming Wei, Xiaowei Zhai, Shixing Fan, Xiaojiao Cheng, Hu Wang, Jianchi Hao

“…Based on the characteristics of low viscosity and permeability, phase change pressurization, and strong adsorption potential energy of liquid CO2, the technology system of liquid CO2 displacement for high-gas and low-permeability coal seam was developed, and field industrial of low-pressure (0.5~2.5 MPa) and medium-pressure (2.5~15.0 MPa) combined injection test was carried out. …”
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Symmetry-invariant quantum machine learning force fields by Isabel Nha Minh Le, Oriel Kiss, Julian Schuhmacher, Ivano Tavernelli, Francesco Tacchino

“…This approach has recently been extended to incorporate quantum computational methods, making use of variational quantum learning models to predict potential energy surfaces and atomic forces from ab initio training data. …”
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Paper Bags vis-à-vis LDPE Bags: Gleanings from Peer-reviewed E-LCA Publications by Isabell Lidbrand, Govindarajan Venkatesh, Magnus Lestelius

“…Environmental impact categories include the global warming potential, energy demand, fossil fuel depletion, water usage, acidification, eutrophication, and a range of toxicities – human, terrestrial, freshwater-aquatic and marine-aquatic. …”
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Distribution of energy in propagation for ocean extreme wave generation in hydrodynamics laboratory by D. Fadhiliani, M. Ikhwan, M. Ramli, S. Rizal, M. Syafwan

“…The Hamiltonian is derived from the appropriate Lagrangian for Nonlinear Schrodinger and then transformed into the Hamiltonian  with the displaced phase-amplitude variable.FINDINGS: Potential energy is related to wave amplitude and kinetic energy is related to wave steepness in the study of surface water waves. …”
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Sensitivity of Dynamical Downscaling Seasonal Precipitation Forecasts to Convection and Land Surface Parameterization in a High-Resolution Regional Climate Model by Yuan Li, Guihua Lu, Hai He, Zhiyong Wu

“…To understand the causes of the differences in precipitation forecasts using different parameterization schemes, the simulated moisture flux convergence, thermodynamic parameters at different pressure levels, convective available potential energy (CAPE), convective inhibition (CIN), and heat fluxes are compared with the data in the ERA-5 reanalysis dataset. …”
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On the Ionosphere–Atmosphere–Lithosphere Coupling During the 9 November 2022 Italian Earthquake by Mirko Piersanti, Giulia D’Angelo, Dario Recchiuti, Fabio Lepreti, Paola Cusano, Enza De Lauro, Vincenzo Carbone, Pietro Ubertini, Mariarosaria Falanga

“…Analysis of atmospheric temperature data from ERA5 reveals a significant increase in potential energy (Ep) at the earthquake’s epicenter, consistent with the generation of Atmospheric Gravity Waves (AGWs). …”
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Innovative thermal control of fermentations through the use of phase change materials: A focus on wine fermentation by Piernicola Masella, Giulia Angeloni, Ferdinando Corti, Agnese Spadi, Francesco Garbati Pegna, Lorenzo Guerrini, Alessandro Parenti

“…The study aimed to investigate the feasibility of using Phase Change Materials (PCM) for temperature management during grape must fermentation, providing insights into potential energy-saving strategies in winemaking processes. …”
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Structural and functional changes of the heart in patients with coronary heart disease who have had coronavirus disease COVID-19 by S. M. Manuilov, N. S. Mykhailovska

“…In CHD patients who suffered from COVID-19, there was an increase in the estimated energy expenditure of the LV myocardium: shock work by 14.77 % (U = 461.5; p < 0.05), potential energy by 34.68 % (U = 316.5; p < 0.05) and the pressure-volume zone by 17.78 % (U = 373.0; p < 0.05), which indicates a decrease in the speed of myocardial recovery in long COVID period. …”
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A Structural Model of Truncated Gaussia princeps Luciferase Elucidating the Crucial Catalytic Function of No.76 Arginine towards Coelenterazine Oxidation. by Nan Wu, Zhi-Chao Xu, Kai-Dong Du, Shen Huang, Naohiro Kobayashi, Yutaka Kuroda, Yan-Hong Bai

“…Both intramolecular electron transfer and the convergence of S1/S0 potential energy surfaces occurred in the last elementary reaction, which was regarded as the reported Chemically-Initiated-Electron-Exchange-Luminescence (CIEEL) reaction. …”
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A Quantum Mermin-Wagner Theorem for a Generalized Hubbard Model by Mark Kelbert, Yurii Suhov

“…The potential part is an operator of multiplication by a function (the potential energy of a classical configuration) which is a sum of (a) one-body potentials U(1)(x), x∈M, describing a field generated by a heavy atom, (b) two-body potentials U(2)(x,y), x,y∈M, showing the interaction between pairs of particles belonging to the same atom, and (c) two-body potentials V(x,y), x,y∈M, scaled along the graph distance d(i,j) between vertices i,j∈Γ, which gives the interaction between particles belonging to different atoms. …”
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Semiclassical Estimates of Pressure-induced Line Widths for Infrared Absorption in Hot (Exo)planetary Atmospheres by Jeanna Buldyreva, Kathleen Stehlin, Sergei N. Yurchenko, Elizabeth R. Guest, Jonathan Tennyson

“…Advanced theoretical approaches (classical, semiclassical, and quantum mechanical), without mentioning their high computational cost, are also impracticable due to the lack of potential energy surfaces. To fill this gap of crucially missing line-broadening parameters, we provide estimated values issued from a simple rotationally independent semiclassical expression. …”
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The anomalously thundery month of June 1925 in southwest Spain: description and synoptic analysis by F. J. Acero, M. Antón, A. J. P. Aparicio, A. J. P. Aparicio, N. Bravo-Paredes, V. M. S. Carrasco, M. C. Gallego, J. A. García, M. Núñez, I. Tovar, J. Vaquero-Martínez, J. M. Vaquero

“…Thereby, a combination of a negative North Atlantic Oscillation (NAO) situation, elevated convective available potential energy (CAPE) values, large-scale lifting, and abundant precipitable water availability in the region was revealed.…”
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Coal‐wall spalling prevention mechanism using advance‐grooving pressure relief in the large‐mining‐height working face of a shallow coal seam by Wang Hongwei, Feng Li, Zhao Zhouyan, Li Yanjun, Cao Peipei, Jiao Jianqiang, Jiang Baolin, Liu Yong

“…At the same time, the strain energy and gravitational potential energy of roof cutting instability are released to form a dynamic load. …”
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Management strategies for the efficient energy production of brackish water desalination to ensure reliability, cost reduction, and sustainability by A. Bdour, A. Hejab, L. Almakhadmeh, M. Hawa

“…A regression model was utilized to determine the potential energy savings resulting from energy conservation measures. …”
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Environment-friendly Ca2+/Cr3+ co-doping LaAlO3 ceramics with excellent infrared radiation performance for energy-saving by Xinglai Yuan, Qinghu Wang, Runke Wu, Shaobai Sang, Yibiao Xu, Xiong Liang, Liping Pan, Bingbing Fan, Yawei Li, Rui Zhang, Jiangtao Li, Olena Volkova

“…Ca2+/Cr3+ co-doped LaAlO3 infrared (IR) ceramics have been proven to be potential energy-saving materials for high-temperature industries because of their high emissivity and high-temperature stability. …”
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Computational analysis of Newtonian fluid in a 2-D square cavity with kinetic energy, enstrophy, and palinstrophy in the presence of bottom corner obstacle by Dalmalka Praveen Kumar, Yadagiri Rameshwar, Rifaqat Ali, S. Nazari, Mohamed Kallel, Ahmed M. Galal

“…In addition, we discovered a new empirical relation among Pressure potential energy (PE) in three configurations for the steady-state solution and it can be generalised and holds for any positive reals H and W up to almost near 1L and 0.50L respectively. …”
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Characterization and simulation of AlGaN barrier structure effects in normally-off recessed gate AlGaN/GaN MISHEMTs by An-Chen Liu, Hsin-Chu Chen, Po-Tsung Tu, Yan-Lin Chen, Yan-Chieh Chen, Po-Chun Yeh, Chih-I Wu, Shu-Tong Chang, Tsung-Sheng Kao, Hao-Chung Kuo

“…This is attributed to the hot electrons effect under the action of the high electric field to promote electrons to overcome potential energy barriers that are injected into a buffer, barrier, or insulating layers and trapped there, degrading off-state BV capability.…”
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Back-illuminated Light-spot-mapping Algorithm for Dual Rotation Robotic Fiber Positioners Based on an Artificial Probability Potential Field Method by Yingfu Wang, Jiahao Zhou, Ziming Liu, Rongfeng Chen, Jiacheng Xie, Hongzhuan Hu, Jianping Wang, Zhigang Liu, Jiaru Chu, Feifan Zhang, Haotong Zhang, Yong Zhang, Zengxiang Zhou

“…This study constructs an artificial probability potential field to calculate the likelihood of each light spot appearing in the patrol area of an RFP, employing a global probability potential energy optimization method to establish the optimal mapping relationship. …”
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