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Viser treff 1-50 av 68
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2024
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1. |
Gullbrekken, Øystein; Gunnarshaug, Astrid Fagertun; Lervik, Anders; Kjelstrup, Signe; Schnell, Sondre Kvalvåg. Effect of the Ion, Solvent, and Thermal Interaction Coefficients on Battery Voltage. Journal of the American Chemical Society 2024 ;Volum 146.(7) s. 4592-4604 NTNU
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2. |
Zhang, Daniel Tianhou; Baldauf, Lukas; Roet, Sander Johannes Simon; Lervik, Anders; van Erp, Titus Sebastiaan. Highly parallelizable path sampling with minimal rejections using asynchronous replica exchange and infinite swaps. Proceedings of the National Academy of Sciences of the United States of America 2024 ;Volum 121. NTNU
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2023
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3. |
Gaardløs, Margrethe; Lervik, Anders; Samsonov, Sergey A.. Computational modeling of the molecular basis for the calcium-dependence of the mannuronan C-5 epimerase AvAlgE6 from Azotobacter vinelandii. Computational and Structural Biotechnology Journal 2023 ;Volum 21. s. 2188-2196 NTNU
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4. |
Gullbrekken, Øystein; Gunnarshaug, Astrid Fagertun; Kjelstrup, Signe; Lervik, Anders; Schnell, Sondre Kvalvåg. Ion transport in lithium-ion battery electrolytes. The effect of gradients on battery voltage. Norwegian NanoSymposium 2023; 2023-11-28 - 2023-11-29 NTNU
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5. |
Gullbrekken, Øystein; Gunnarshaug, Astrid Fagertun; Kjelstrup, Signe; Lervik, Anders; Schnell, Sondre Kvalvåg. The effect of ion, solvent and thermal interaction coefficients on battery voltage. The case of the lithium-ion battery electrolyte. InterPore 2023; 2023-05-22 - 2023-05-25 NTNU
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6. |
Kjelstrup, Signe Helene; Gunnarshaug, Astrid Fagertun; Gullbrekken, Øystein; Schnell, Sondre Kvalvåg; Lervik, Anders. Transport coefficients for ion and solvent coupling. The case of the lithium-ion battery electrolyte. Journal of Chemical Physics 2023 ;Volum 159.(3) s. 035104-035116 NTNU
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7. |
Zhang, Daniel Tianhou; Baldauf, Lukas; Roet, Sander Johannes Simon; Lervik, Anders; van Erp, Titus Sebastiaan. Highly Parallel Path Sampling with Asynchronous and Infinite Replica Exchange. TRAINS conference; 2023-11-27 - 2023-11-30 NTNU
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2022
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8. |
Torstensen, Jonathan Økland; Ottesen, Vegar; Rodríguez-Fabià, Sandra; Syverud, Kristin; Johansson, Lars; Lervik, Anders. The influence of temperature on cellulose swelling at constant water density. Scientific Reports 2022 ;Volum 12.(1) s. - NTNU HVL RISE-PFI
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9. |
Bering, Eivind; Torstensen, Jonathan Økland; Lervik, Anders; de Wijn, Astrid S.. Computational study of the dissolution of cellulose into single chains: the role of the solvent and agitation. Cellulose 2022 s. - NTNU HVL
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10. |
Lervik, Anders; Svenum, Ingeborg-Helene; Wang, Zhaohui; Cabriolu, Raffaela; Riccardi, Enrico; Andersson, Stefan; van Erp, Titus Sebastiaan. The role of pressure and defects in the wurtzite to rock salt transition in cadmium selenide. Physical Chemistry, Chemical Physics - PCCP 2022 ;Volum 24.(14) s. 8378-8386 NTNU SINTEF UiO
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11. |
; Granerud, Selma Tofte. Analyse glycol ether and pesticide metabolites in Norwegian children and their potential determinants. Trondheim: Institutt for kjemi, Norges teknisk-naturvitenskapelige universitet 2022 113 s. NTNU
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12. |
Sæther, Sandra; Erichsen, Merete Falck; Xiao, Senbo; Zhang, Zhiliang; Lervik, Anders; He, Jianying. Phonon thermal transport in copper: The effect of size, crystal orientation, and grain boundaries. AIP Advances 2022 ;Volum 12.(6) s. - NTNU
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13. |
; rossvoll, jostein. Extracting Dynamical Information from Complex Systems using Advanced Path Sampling Techniques. : NTNU 2022 48 s. NTNU
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14. |
; selavko, katrina. Protein Folding of Chignolin. : NTNU 2022 100 s. NTNU
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2021
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15. |
Kjelstrup, Signe; Lervik, Anders. The energy conversion in active transport of ions. Proceedings of the National Academy of Sciences of the United States of America 2021 ;Volum 118.(45) s. - NTNU
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16. |
Kopplin, Georg; Lervik, Anders; Draget, Kurt Ingar; Aachmann, Finn Lillelund. Alginate gels crosslinked with chitosan oligomers - a systematic investigation into alginate block structure and chitosan oligomer interaction. RSC Advances 2021 ;Volum 11.(23) s. 13780-13798 NTNU
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17. |
Lervik, Anders. The Soret Effect in Li-Ion Battery Electrolytes. Twenty-First Symposium on Thermophysical Properties; 2021-06-20 - 2021-06-25 NTNU
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18. |
Sæther, Sandra; Erichsen, Merete Falck; Zhang, Zhiliang; Lervik, Anders; He, Jianying. Thermal transport in polyethylene: The effect of force fields and crystallinity. Macromolecules 2021 ;Volum 54.(13) s. 6563-6574 NTNU
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2020
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19. |
Dahlen, Oda; Lervik, Anders; Aarøen, Ola; Cabriolu, Raffaela; Lyng, Reidar; van Erp, Titus Sebastiaan. Teaching complex molecular simulation algorithms: Using self‐evaluation to tailor web‐based exercises at an individual level. Computer Applications in Engineering Education 2020 ;Volum 28.(4) s. 779-791 NTNU
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20. |
Stanisci, Annalucia; Tøndervik, Anne; Gaardløs, Margrethe; Lervik, Anders; Skjåk-Bræk, Gudmund; Sletta, Håvard; Aachmann, Finn Lillelund. Identification of a Pivotal Residue for Determining the Block Structure-Forming Properties of Alginate C-5 Epimerases. ACS Omega 2020 ;Volum 5.(8) s. 4352-4361 SINTEF NTNU
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2019
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21. |
Cruz, Carolina; Barragán, Daniel; Magnanelli, Elisa; Lervik, Anders; Kjelstrup, Signe. Non-equilibrium thermodynamics as a tool to compute temperature at the catalyst surface. Physical Chemistry, Chemical Physics - PCCP 2019 ;Volum 21.(27) s. 15195-15205 NTNU
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22. |
Gaardløs, Margrethe; Tøndervik, Anne; Lervik, Anders; Hjørnevik, Maya; Sætrom, Gerd Inger; Aachmann, Finn Lillelund. Enzymatic design of biopolymers with alginate epimerases. Biotrans 2019; 2019-07-07 - 2019-07-11 SINTEF NTNU
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23. |
Gaardløs, Margrethe; Tøndervik, Anne; Lervik, Anders; Hjørnevik, Maya; Sætrom, Gerd Inger; Aachmann, Finn Lillelund. Enzymatic design of biopolymers with alginate epimerases. CBM13 - Carbohydrate bioengineering meeting; 2019-05-19 - 2019-05-22 SINTEF NTNU
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24. |
Ok, Salim; Mahmoodinia, Mehdi; Rajasekaran, Navvamani; Sabti, Mohamed A.; Lervik, Anders; van Erp, Titus Sebastiaan; Cabriolu, Raffaela. Molecular Structure and Solubility Determination of Asphaltenes. Energy & Fuels 2019 ;Volum 33.(9) s. 8258-8270 NTNU
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25. |
Riccardi, Enrico; Lervik, Anders; Roet, Sander; Aarøen, Ola; van Erp, Titus Sebastiaan. PyRETIS 2: An improbability drive for rare events. Journal of Computational Chemistry 2019 ;Volum 41.(4) s. - NTNU
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26. |
Stanisci, Annalucia; Gaardløs, Margrethe; Lervik, Anders; Tøndervik, Anne; Sletta, Håvard; Skjåk-Bræk, Gudmund; Aachmann, Finn Lillelund. Identification of a pivotal residue for determining the block structure forming properties of alginate C-5 epimerases. CBM 13 - CARBOHYDRATE BIOENGINEERING MEETING; 2019-05-19 - 2019-05-22 SINTEF NTNU
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2018
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27. |
Gaardløs, Margrethe; Tøndervik, Anne; Lervik, Anders; Hjørnevik, Maya; Sætrom, Gerd Inger; Aachmann, Finn Lillelund. Using alginate epimerases as a basis to understand polymer and protein design. Norwegian Biochemical Society 54th Contact Meeting; 2018-01-18 - 2018-01-21 NTNU SINTEF
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28. |
Moqadam, Mahmoud; Lervik, Anders; Riccardi, Enrico; Venkatraman, Vishwesh; Alsberg, Bjørn Kåre; van Erp, Titus Sebastiaan. Local initiation conditions for water autoionization. Proceedings of the National Academy of Sciences of the United States of America 2018 ;Volum 115.(20) s. E4569-E4576 NTNU
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29. |
Riccardi, Enrico; Lervik, Anders; van Erp, Titus Sebastiaan. Multiscale resolution -in time- rare events simulations. Multi-resolution simulations of intracellular processes; 2018-08-24 - 2018-08-25 NTNU
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30. |
Svenum, Ingeborg-Helene; Wang, Zhaohui; Lervik, Anders; Armstrong, Jeff; van Erp, Titus Sebastiaan; Andersson, Stefan. Modelling phase transformations in silicon materials. Norwegian Solar Cell Conference; 2018-05-02 - 2018-05-03 NTNU SINTEF
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31. |
van Erp, Titus Sebastiaan; Lervik, Anders; Riccardi, Enrico. Reaching long time scales with PyRETIS: A well-done, medium-sized python library for rare events. SCM developers day; 2018-03-26 - 2018-03-29 NTNU
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32. |
Wilhelmsen, Øivind; Trinh, Thuat; Lervik, Anders. Temperature anisotropy at equilibrium reveals nonlocal entropic contributions to interfacial properties. Physical Review E (PRE) 2018 ;Volum 97. s. - NTNU ENERGISINT
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33. |
Wilhelmsen, Øivind; Trinh, Thuat; Lervik, Anders; Magnanelli, Elisa; Kjelstrup, Signe; Bedeaux, Dick. Transport of Heat and Mass across Planar and Curved Vapor-Liquid Interfaces: from the Lennard Jones Fluid to Water and Beyond. Twentienth Symposium on Thermophysical Properties; 2018-06-25 - 2018-06-29 ENERGISINT NTNU
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2017
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34. |
Lervik, Anders; Riccardi, Enrico; van Erp, Titus Sebastiaan. PyRETIS: A well-done, medium-sized python library for rare events. Journal of Computational Chemistry 2017 ;Volum 38.(28) s. 2439-2451 NTNU
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35. |
Moqadam, Mahmoud; Riccardi, Enrico; Trinh, Thuat; Lervik, Anders; van Erp, Titus Sebastiaan. Rare event simulations reveal subtle key steps in aqueous silicate condensation. Physical Chemistry, Chemical Physics - PCCP 2017 ;Volum 19.(20) s. 13361-13371 NTNU
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36. |
Rubi, Miguel; Lervik, Anders; Bedeaux, Dick; Kjelstrup, Signe. Entropy facilitated active transport. Journal of Chemical Physics 2017 ;Volum 146.(18) s. - NTNU
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37. |
van Erp, Titus Sebastiaan; Lervik, Anders; Moqadam, Mahmoud; Riccardi, Enrico. Concerted and stepwise autoionization of water. ICCMSE 2017; 2017-04-21 - 2017-04-25 NTNU
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38. |
van Erp, Titus Sebastiaan; Moqadam, Mahmoud; Lervik, Anders; Riccardi, Enrico; Trinh, Thuat. Rare event simulations reveal subtle key steps in aqueous silicate condensation. FEMEX-NL 2017; 2017-06-22 - 2017-06-25 NTNU
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39. |
Wilhelmsen, Øivind; Trinh, Thuat; Lervik, Anders; Magnanelli, Elisa; Aasen, Ailo; Kjelstrup, Signe Helene; Bedeaux, Dick. Transport of heat and mass across planar and curved vapor-liquid interfaces: From the Lennard Jones fluid to water and beyond. Physics and Chemistry at Fluid/Fluid Interfaces; 2017-12-11 - 2017-12-13 ENERGISINT NTNU
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2016
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40. |
Lervik, Anders; Wilhelmsen, Øivind; Trinh, Thuat; Blokhuis, Edgar M.. Note: A new truncation correction for the configurational temperature extends its applicability to interaction potentials with a discontinuous force. Journal of Chemical Physics 2016 ;Volum 144. NTNU ENERGISINT
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41. |
van Erp, Titus Sebastiaan; Moqadam, Mahmoud; Riccardi, Enrico; Lervik, Anders. Analyzing Complex Reaction Mechanisms Using Path Sampling. Journal of Chemical Theory and Computation 2016 ;Volum 12.(11) s. 5398-5410 NTNU
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42. |
van Erp, Titus Sebastiaan; Moqadam, Mahmoud; Riccardi, Enrico; Lervik, Anders. Reaction coordinates from molecular trajectories. Lorentz center WORKSHOP: Reaction coordinates from molecular trajectories; 2016-08-29 - 2016-09-02 NTNU
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43. |
Wilhelmsen, Øivind; Trinh, Thuat; Lervik, Anders; Badam, Vijay Kumar; Kjelstrup, Signe; Bedeaux, Dick. Coherent description of transport across the water interface: From nanodroplets to climate models. Physical Review E (PRE) 2016 ;Volum 39. s. - NTNU
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2015
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44. |
Lervik, Anders; Kjelstrup, Signe; Qian, Hong. Michaelis-Menten kinetics under non-isothermal conditions. Physical Chemistry, Chemical Physics - PCCP 2015 ;Volum 17.(2) s. 1317-1324 NTNU
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45. |
Lervik, Anders; van Erp, Titus Sebastiaan. Gluing Potential Energy Surfaces with Rare Event Simulations. Journal of Chemical Theory and Computation 2015 ;Volum 11.(6) s. 2440-2450 NTNU
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46. |
Lervik, Anders; van Erp, Titus Sebastiaan. Gluing potential energy surfaces with rare event simulations. CECAM Workshop - From trajectories to reaction coordinates: making sense of molecular simulation data; 2015-09-16 - 2015-09-18 NTNU
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47. |
Lervik, Anders; van Erp, Titus Sebastiaan. Gluing potential energy surfaces with rare event simulations. Mainz Materials Simulation Days 2015; 2015-06-10 - 2015-06-12 NTNU
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48. |
Lervik, Anders; van Erp, Titus Sebastiaan. Gluing potential energy surfaces with rare event simulations. Årsmøte NKS; 2015-06-29 - 2015-06-30 NTNU
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49. |
Lervik, Anders; Wilhelmsen, Øivind; Trinh, Thuat; Nagel, Henrik Rojas. Finite-size and truncation effects for microscopic expressions for the temperature at equilibrium and nonequilibrium. Journal of Chemical Physics 2015 ;Volum 143.(11) s. - NTNU
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50. |
van Erp, Titus Sebastiaan; Riccardi, Enrico; Lervik, Anders. A new approach to analyze path ensembles. From trajectories to reaction coordinates: making sense of molecular simulation data, CECAM workshop at the Erwin Schrodinger Institute in Vienna; 2015-09-16 - 2015-09-18 NTNU
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