Results 11 to 20 of about 1,381,598 (313)
Molecular thermal motion harvester for electricity conversion via triboelectrification [PDF]
APL MaterialsMolecular thermal motion is ubiquitous, and in theory, the energy of which could be converted into electrical energy. However, not until recently, the conversion of molecular thermal motion into electricity was demonstrated feasible for the first time ...
Yucheng Luan, Shaohua Chang, Mengshi Lu
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A molecular dynamics study of the lateral free energy profile of a pair of cholesterol molecules as a function of their distance in phospholipid bilayers [PDF]
, 2012 Free energy profile of a pair of cholesterol molecules in a leaflet of 1-palmitoyl-2-oleoyl-phosphatidylcholine (POPC) bilayers in the liquid-crystalline phase has been calculated as a function of their lateral distance using a combination of NPT ...
Oono, Kimiko +7 more
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Message Passing-Based Inference for Time-Varying Autoregressive Models
Entropy, 2021 Time-varying autoregressive (TVAR) models are widely used for modeling of non-stationary signals. Unfortunately, online joint adaptation of both states and parameters in these models remains a challenge.
Albert Podusenko +2 more
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Properties of the free energy barriers for folding of the [alpha]-amylase inhibitor tendamistat [PDF]
, 2005 The goal of this work was to improve our understanding of the properties of the free energy barriers in protein folding. We used the small all-[beta]-sheet protein tendamistat as a model protein. Tendamistat contains two disulfide bridges and folds and
Schätzle, Manuela
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Entropy, 2022 The Jarzynski equality (JE) was originally derived under the deterministic Hamiltonian formalism, and later, it was demonstrated that stochastic Langevin dynamics also lead to the JE.
Javier Varillas, Lamberto Rondoni
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Metastable States of Water Aerosols: Comparison by Experiment
Atmosphere, 2021 Free energy of water aerosol plasma was calculated using the Debye–Hückel method. It was established that free energies of droplets, ions and simultaneously of all charged particles had local minima (metastable states) at certain concentrations and ...
Anatoly V. Shavlov +2 more
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On the Decomposition of Free Energies
Journal of Molecular Biology, 1996 The decomposition of free energies and entropies into components has recently been discussed within the framework of the free energy perturbation (FEP) and thermodynamic integration (TI) methods. In FEP, the cumulant expansion of the excess free energy contains coupling terms in second and higher orders.
G P, Brady, A, Szabo, K A, Sharp
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Entropy, 2021 Our intention is to provide easy methods for estimating entropy and chemical potentials for gas phase reactions. Clausius’ virial theorem set a basis for relating kinetic energy in a body of independent material particles to its potential energy ...
Ivan R. Kennedy, Migdat Hodzic
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Entropy, 2021 About a century ago, in the spirit of ancient atomism, the quantum of light was renamed the photon to suggest that it is the fundamental element of everything. Since the photon carries energy in its period of time, a flux of photons inexorably embodies a
Arto Annila
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A determination of interface free energies [PDF]
Nuclear Physics B, 1994 We determine the interface free energy $F_{o.d.}$ between disordered and ordered phases in the q=10 and q=20 2-d Potts models using the results of multicanonical Monte Carlo simulations on $L^2$ lattices, and suitable finite volume estimators. Our results, when extrapolated to the infinite volume limit, agree to high precision with recent analytical ...
BILLOIRE, A, Neuhaus, Thomas, BERG, BA
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