-
1
-
-
0005004861
-
Enhanced Electrocatalysis of Oxygen Reduction on Platinum Alloys in Proton Exchange Membrane Fuel Cells
-
Mukerjee, S.; Srinivasan, S. Enhanced Electrocatalysis of Oxygen Reduction on Platinum Alloys in Proton Exchange Membrane Fuel Cells J. Electroanal. Chem. 1993, 357, 201-224
-
(1993)
J. Electroanal. Chem.
, vol.357
, pp. 201-224
-
-
Mukerjee, S.1
Srinivasan, S.2
-
2
-
-
1442324492
-
Proton Exchange Membrane Fuel Cells with Carbon Nanotube Based Electrodes
-
Wang, C.; Waje, M.; Wang, X.; Tang, J. M.; Haddon, R. C.; Yan, Y. Proton Exchange Membrane Fuel Cells with Carbon Nanotube Based Electrodes Nano Lett. 2004, 4, 345-348
-
(2004)
Nano Lett.
, vol.4
, pp. 345-348
-
-
Wang, C.1
Waje, M.2
Wang, X.3
Tang, J.M.4
Haddon, R.C.5
Yan, Y.6
-
3
-
-
69649107151
-
2 from Air for Delivering Energy
-
2 from Air for Delivering Energy J. Power Sources 2010, 195, 358-361
-
(2010)
J. Power Sources
, vol.195
, pp. 358-361
-
-
Wang, Y.1
Zhou, H.2
-
4
-
-
84855328636
-
A Critical Review of Li/Air Batteries
-
Christensena, J.; Albertusa, P.; Sanchez-Carrerab, R. S.; Lohmanna, T.; Kozinskyb, B.; Liedtkec, R.; Ahmeda, J.; Kojica, A. A Critical Review of Li/Air Batteries J. Electrochem. Soc. 2012, 159, R1-R30
-
(2012)
J. Electrochem. Soc.
, vol.159
, pp. 1-R30
-
-
Christensena, J.1
Albertusa, P.2
Sanchez-Carrerab, R.S.3
Lohmanna, T.4
Kozinskyb, B.5
Liedtkec, R.6
Ahmeda, J.7
Kojica, A.8
-
5
-
-
27944444164
-
Instability of Pt/C Electrocatalysts in Proton Exchange Membrane Fuel Cells: A Mechanistic Investigation
-
Ferreira, P. J.; la O, G. J.; Shao-Horn, Y.; Morgan, D.; Makharia, R.; Kocha, S.; Gasteiger, H. A. Instability of Pt/C Electrocatalysts in Proton Exchange Membrane Fuel Cells: A Mechanistic Investigation J. Electrochem. Soc. 2005, 152, A2256-A2271
-
(2005)
J. Electrochem. Soc.
, vol.152
, pp. 2256-A2271
-
-
Ferreira, P.J.1
La, O.G.J.2
Shao-Horn, Y.3
Morgan, D.4
Makharia, R.5
Kocha, S.6
Gasteiger, H.A.7
-
6
-
-
33846633795
-
Stabilization of Platinum Oxygen-Reduction Electrocatalysts Using Gold Clusters
-
Zhang, J.; Sakaki, K.; Sutter, E.; Adzic, R. R. Stabilization of Platinum Oxygen-Reduction Electrocatalysts Using Gold Clusters Science 2007, 315, 220-222
-
(2007)
Science
, vol.315
, pp. 220-222
-
-
Zhang, J.1
Sakaki, K.2
Sutter, E.3
Adzic, R.R.4
-
7
-
-
34250744649
-
Supportless Pt and PtPd Nanotubes as Electrocatalysts for Oxygen-Reduction Reactions
-
Chen, Z. W.; Waje, M.; Li, W. Z.; Yan, Y. S. Supportless Pt and PtPd Nanotubes as Electrocatalysts for Oxygen-Reduction Reactions Angew. Chem., Int. Ed. 2007, 46, 4060-4063
-
(2007)
Angew. Chem., Int. Ed.
, vol.46
, pp. 4060-4063
-
-
Chen, Z.W.1
Waje, M.2
Li, W.Z.3
Yan, Y.S.4
-
8
-
-
65549098163
-
Au-Ag Alloy Nanoporous Nanotubes
-
Gu, X.; Xu, L.; Tian, F.; Ding, Y. Au-Ag Alloy Nanoporous Nanotubes Nano. Res. 2009, 2, 386-393
-
(2009)
Nano. Res.
, vol.2
, pp. 386-393
-
-
Gu, X.1
Xu, L.2
Tian, F.3
Ding, Y.4
-
9
-
-
71949114159
-
Nanoporous Pt-Co Alloy Nanowires: Fabrication, Characterization, and Electrocatalytic Properties
-
Liu, L.; Pippel, E.; Scholz, R.; Gosele, U. Nanoporous Pt-Co Alloy Nanowires: Fabrication, Characterization, and Electrocatalytic Properties Nano Lett. 2009, 9, 4352-4358
-
(2009)
Nano Lett.
, vol.9
, pp. 4352-4358
-
-
Liu, L.1
Pippel, E.2
Scholz, R.3
Gosele, U.4
-
10
-
-
84902191609
-
Enhanced Electrocatalytic Activity and Durability of Pt Particles Supported on Ordered Mesoporous Carbon Spheres
-
Zhang, C.; Xu, L.; Shan, N.; Sun, T.; Chen, J.; Yan, Y. Enhanced Electrocatalytic Activity and Durability of Pt Particles Supported on Ordered Mesoporous Carbon Spheres ACS Catal. 2014, 4, 1926-1930
-
(2014)
ACS Catal.
, vol.4
, pp. 1926-1930
-
-
Zhang, C.1
Xu, L.2
Shan, N.3
Sun, T.4
Chen, J.5
Yan, Y.6
-
11
-
-
79955446800
-
Bulk Metallic Glass Nanowire Architecture for Electrochemical Applications
-
Carmo, M.; Sekol, R. C.; Ding, S.; Kumar, G.; Schroers, J.; Taylor, A. D. Bulk Metallic Glass Nanowire Architecture for Electrochemical Applications ACS Nano 2011, 5, 2979-2983
-
(2011)
ACS Nano
, vol.5
, pp. 2979-2983
-
-
Carmo, M.1
Sekol, R.C.2
Ding, S.3
Kumar, G.4
Schroers, J.5
Taylor, A.D.6
-
12
-
-
33947158675
-
Super Plastic Bulk Metallic Glasses at Room Temperature
-
Liu, Y. H.; Wang, G.; Wang, R. J.; Zhao, D. Q.; Pan, M. X.; Wang, W. H. Super Plastic Bulk Metallic Glasses at Room Temperature Science 2007, 315, 1385-1388
-
(2007)
Science
, vol.315
, pp. 1385-1388
-
-
Liu, Y.H.1
Wang, G.2
Wang, R.J.3
Zhao, D.Q.4
Pan, M.X.5
Wang, W.H.6
-
13
-
-
84887479466
-
Enhanced Fatigue Endurance of Metallic Glassis through a Stair-case-like Fracture Mechanism
-
Gludovatz, B.; Demetriou, M. D.; Floyd, M.; Hohenwarter, A.; Johnson, W. L.; Ritchie, R. O. Enhanced Fatigue Endurance of Metallic Glassis through a Stair-case-like Fracture Mechanism Proc. Natl. Acad. Sci. U.S.A. 2013, 110, 18419-18424
-
(2013)
Proc. Natl. Acad. Sci. U.S.A.
, vol.110
, pp. 18419-18424
-
-
Gludovatz, B.1
Demetriou, M.D.2
Floyd, M.3
Hohenwarter, A.4
Johnson, W.L.5
Ritchie, R.O.6
-
14
-
-
77951226100
-
Processing of Bulk Metallic Glass
-
Schroers, J. Processing of Bulk Metallic Glass Adv. Mater. 2010, 22, 1566-1569
-
(2010)
Adv. Mater.
, vol.22
, pp. 1566-1569
-
-
Schroers, J.1
-
15
-
-
84880744313
-
Geometric Frustration of Icosahedron in Metallic Glasses
-
Hirata, A.; Kang, L. J.; Fujita, T.; Klumov, B.; Matsue, K.; Kotani, M.; Yavari, A. R.; Chen, M. W. Geometric Frustration of Icosahedron in Metallic Glasses Science 2013, 341, 376-379
-
(2013)
Science
, vol.341
, pp. 376-379
-
-
Hirata, A.1
Kang, L.J.2
Fujita, T.3
Klumov, B.4
Matsue, K.5
Kotani, M.6
Yavari, A.R.7
Chen, M.W.8
-
16
-
-
80155144404
-
20 Bulk Metallic Glass from ab Initio Simulations
-
20 Bulk Metallic Glass from ab Initio Simulations Phys. Rev. B 2011, 84, 134204
-
(2011)
Phys. Rev. B
, vol.84
, pp. 134204
-
-
Kumar, V.1
Fujita, T.2
Konno, K.3
Matsuura, M.4
Chen, M.5
Inoue, A.6
Kawazoe, Y.7
-
17
-
-
0016335165
-
Thermodynamic Considerations on the Formation and Stability of Metallic Glasses
-
Chen, H. S. Thermodynamic Considerations on the Formation and Stability of Metallic Glasses Acta Metall. 1974, 22, 1505-1511
-
(1974)
Acta Metall.
, vol.22
, pp. 1505-1511
-
-
Chen, H.S.1
-
18
-
-
0033907537
-
Stabilization of Metallic Supercooled Liquid and Bulk Amorphous Alloys
-
Inoue, A. Stabilization of Metallic Supercooled Liquid and Bulk Amorphous Alloys Acta Mater. 2000, 48, 279-306
-
(2000)
Acta Mater.
, vol.48
, pp. 279-306
-
-
Inoue, A.1
-
19
-
-
79951677955
-
Recent Development and Application Products of Bulk Glassy Alloys
-
Inoue, A.; Takeuchi, A. Recent Development and Application Products of Bulk Glassy Alloys Acta Mater. 2011, 59, 2243-2267
-
(2011)
Acta Mater.
, vol.59
, pp. 2243-2267
-
-
Inoue, A.1
Takeuchi, A.2
-
20
-
-
0036858564
-
Stability and Nucleation Behavior of Glass-forming Pd-Cu-Ni-P Alloy with a Critical Cooling Rate of 0.067 K/s
-
Nishiyama, N.; Inoue, A. Stability and Nucleation Behavior of Glass-forming Pd-Cu-Ni-P Alloy with a Critical Cooling Rate of 0.067 K/s Intermetallics 2002, 10, 1141-1147
-
(2002)
Intermetallics
, vol.10
, pp. 1141-1147
-
-
Nishiyama, N.1
Inoue, A.2
-
21
-
-
43049097184
-
Bimetallic Pd-Cu Oxygen Reduction Electrocatalysts
-
Wang, X.; Kariuki, N.; Vaughey, J.; Goodpaster, J.; Kumar, R.; Myers, D. Bimetallic Pd-Cu Oxygen Reduction Electrocatalysts J. Electrochem. Soc. 2008, 155, B602-B609
-
(2008)
J. Electrochem. Soc.
, vol.155
, pp. 602-B609
-
-
Wang, X.1
Kariuki, N.2
Vaughey, J.3
Goodpaster, J.4
Kumar, R.5
Myers, D.6
-
22
-
-
70350513282
-
Palladium-copper Alloys as Catalysts for the Oxygen Reduction Reaction in an Acidic Media 1: Correlation between the ORR Kinetic Parameters and Intrinsic Physical Properties of the Alloys
-
Founda-Onana, F.; Bah, S.; Savadogo, O. Palladium-copper Alloys as Catalysts for the Oxygen Reduction Reaction in an Acidic Media 1: Correlation between the ORR Kinetic Parameters and Intrinsic Physical Properties of the Alloys J. Electroanal. Chem. 2009, 636, 1-9
-
(2009)
J. Electroanal. Chem.
, vol.636
, pp. 1-9
-
-
Founda-Onana, F.1
Bah, S.2
Savadogo, O.3
-
23
-
-
11544320930
-
Effect of Strain on the Reactivity of Metal Surfaces
-
Mavrikakis, M.; Hammer, B.; Nørskov, J. K. Effect of Strain on the Reactivity of Metal Surfaces Phys. Rev. Lett. 1998, 81, 2819-2822
-
(1998)
Phys. Rev. Lett.
, vol.81
, pp. 2819-2822
-
-
Mavrikakis, M.1
Hammer, B.2
Nørskov, J.K.3
-
24
-
-
50249152519
-
Mechanical Behavior of Metallic Glasses: Microscopic Understanding of Strength and Ductility
-
Chen, M. W. Mechanical Behavior of Metallic Glasses: Microscopic Understanding of Strength and Ductility Annu. Rev. Mater. Res. 2008, 38, 445-469
-
(2008)
Annu. Rev. Mater. Res.
, vol.38
, pp. 445-469
-
-
Chen, M.W.1
-
26
-
-
34250825283
-
Stress-induced Structural Transformation and Shear Banding during Simulated Nanoindentation of a Metallic Glass
-
Shi, Y.; Falk, M. L. Stress-induced Structural Transformation and Shear Banding during Simulated Nanoindentation of a Metallic Glass Acta Mater. 2007, 55, 4317-4324
-
(2007)
Acta Mater.
, vol.55
, pp. 4317-4324
-
-
Shi, Y.1
Falk, M.L.2
-
27
-
-
84889600006
-
Designing Novel Bulk Metallic Glass Composites with a High Aluminum Content
-
Chen, Z. P.; Gao, J. E.; Wu, Y.; Wang, H.; Liu, X. J.; Lu, Z. P. Designing Novel Bulk Metallic Glass Composites with a High Aluminum Content Sci. Rep. 2013, 3, 3353
-
(2013)
Sci. Rep.
, vol.3
, pp. 3353
-
-
Chen, Z.P.1
Gao, J.E.2
Wu, Y.3
Wang, H.4
Liu, X.J.5
Lu, Z.P.6
-
28
-
-
9744261716
-
Origin of the Overpotential for Oxygen Reduction at a Fuel-Cell Cathode
-
Nørskov, J. K.; Rossmeisl, J.; Logadottir, A.; Lindqvist, L.; Kitchin, J. R.; Bligaard, T.; Jónsson, H. Origin of the Overpotential for Oxygen Reduction at a Fuel-Cell Cathode J. Phys. Chem. B 2004, 108, 17886-17892
-
(2004)
J. Phys. Chem. B
, vol.108
, pp. 17886-17892
-
-
Nørskov, J.K.1
Rossmeisl, J.2
Logadottir, A.3
Lindqvist, L.4
Kitchin, J.R.5
Bligaard, T.6
Jónsson, H.7
-
29
-
-
17044363177
-
Controlling the Catalytic Activity of Platinum-Monolayer Electrocatalysts for Oxygen Reduction with Different Substrates
-
Zhang, J. L.; Vukmirovic, M. B.; Xu, Y.; Mavrikakis, M.; Adzic, R. R. Controlling the Catalytic Activity of Platinum-Monolayer Electrocatalysts for Oxygen Reduction with Different Substrates Angew. Chem., Int. Ed. 2005, 44, 2132-2135
-
(2005)
Angew. Chem., Int. Ed.
, vol.44
, pp. 2132-2135
-
-
Zhang, J.L.1
Vukmirovic, M.B.2
Xu, Y.3
Mavrikakis, M.4
Adzic, R.R.5
-
30
-
-
33746191897
-
Changing the Activity of Electrocatalysts for Oxygen Reduction by Tuning the Surface Electronic Structure
-
Stamenkovic, V.; Mun, B. S.; Mayrhofer, K. J.; Ross, P. N.; Marković, N. M.; Rossmeisl, J.; Greeley, J.; Nørskov, J. K. Changing the Activity of Electrocatalysts for Oxygen Reduction by Tuning the Surface Electronic Structure Angew. Chem., Int. Ed. 2006, 45, 2897-2901
-
(2006)
Angew. Chem., Int. Ed.
, vol.45
, pp. 2897-2901
-
-
Stamenkovic, V.1
Mun, B.S.2
Mayrhofer, K.J.3
Ross, P.N.4
Marković, N.M.5
Rossmeisl, J.6
Greeley, J.7
Nørskov, J.K.8
-
31
-
-
33846596556
-
3Ni(111) via Increased Surface Site Availability
-
3Ni(111) via Increased Surface Site Availability Science 2007, 315, 493-496
-
(2007)
Science
, vol.315
, pp. 493-496
-
-
Stamenkovic, V.R.1
Fowler, B.2
Mun, B.S.3
Wang, G.F.4
Ross, P.N.5
Lucas, C.A.6
Marković, N.M.7
-
32
-
-
70349554396
-
Alloys of Platinum and Early Transition Metals as Oxygen Reduction Electrocatalysts
-
Greeley, J.; Stephens, I. E. L.; Bondarenko, A. S.; Johansson, T. P.; Hansen, H. A.; Jaramillo, T. F.; Rossmeisl, J.; Chorkendorff, I.; Nørskov, J. K. Alloys of Platinum and Early Transition Metals as Oxygen Reduction Electrocatalysts Nat. Chem. 2009, 1, 552-556
-
(2009)
Nat. Chem.
, vol.1
, pp. 552-556
-
-
Greeley, J.1
Stephens, I.E.L.2
Bondarenko, A.S.3
Johansson, T.P.4
Hansen, H.A.5
Jaramillo, T.F.6
Rossmeisl, J.7
Chorkendorff, I.8
Nørskov, J.K.9
-
33
-
-
0038536735
-
Universality in Heterogeneous Catalysis
-
Nørskov, J. K.; Bligaard, T.; Logadottir, A.; Bahn, S.; Hansen, L. B.; Bollinger, M.; Bengaard, H.; Hammer, B.; Sljivancanin, Z.; Mavrikakis, M. Universality in Heterogeneous Catalysis J. Catal. 2002, 209, 275-278
-
(2002)
J. Catal.
, vol.209
, pp. 275-278
-
-
Nørskov, J.K.1
Bligaard, T.2
Logadottir, A.3
Bahn, S.4
Hansen, L.B.5
Bollinger, M.6
Bengaard, H.7
Hammer, B.8
Sljivancanin, Z.9
Mavrikakis, M.10
-
34
-
-
34547263439
-
Scaling Properties of Adsorption Energies for Hydrogen-Containing Molecules on Transition-Metal Surfaces
-
Abild-Pedersen, F.; Greeley, J.; Studt, F.; Rossmeisl, J.; Munter, T. R.; Moses, P. G.; Skúlason, E.; Bligaard, T.; Nørskov, J. K. Scaling Properties of Adsorption Energies for Hydrogen-Containing Molecules on Transition-Metal Surfaces Phys. Rev. Lett. 2007, 99, 016105
-
(2007)
Phys. Rev. Lett.
, vol.99
, pp. 016105
-
-
Abild-Pedersen, F.1
Greeley, J.2
Studt, F.3
Rossmeisl, J.4
Munter, T.R.5
Moses, P.G.6
Skúlason, E.7
Bligaard, T.8
Nørskov, J.K.9
-
35
-
-
84901716960
-
Tuning Nanoparticle Structure and Surface Strain for Catalysis Optimization
-
Zhang, S.; Zhang, X.; Jiang, G. M.; Zhu, H.; Guo, S. J.; Su, D.; Lu, G.; Sun, S. H. Tuning Nanoparticle Structure and Surface Strain for Catalysis Optimization J. Am. Chem. Soc. 2014, 136, 7734-7739
-
(2014)
J. Am. Chem. Soc.
, vol.136
, pp. 7734-7739
-
-
Zhang, S.1
Zhang, X.2
Jiang, G.M.3
Zhu, H.4
Guo, S.J.5
Su, D.6
Lu, G.7
Sun, S.H.8
-
36
-
-
0002467378
-
Fast Parallel Algorithms for Short-Range Molecular Dynamics
-
Plimpton, S. J. Fast Parallel Algorithms for Short-Range Molecular Dynamics J. Comput. Phys. 1995, 117, 1-19
-
(1995)
J. Comput. Phys.
, vol.117
, pp. 1-19
-
-
Plimpton, S.J.1
-
37
-
-
67449141697
-
Atomic Level Structure in Multicomponent Bulk Metallic Glass
-
Cheng, Y. Q.; Ma, E.; Sheng, H. Atomic Level Structure in Multicomponent Bulk Metallic Glass Phys. Rev. Lett. 2009, 102, 245501
-
(2009)
Phys. Rev. Lett.
, vol.102
, pp. 245501
-
-
Cheng, Y.Q.1
Ma, E.2
Sheng, H.3
-
38
-
-
79961080774
-
Highly Optimized Embedded-Atom-Method Potentials for Fourteen FCC Metals
-
Sheng, H. W.; Kramer, M. J.; Cadien, A.; Fujita, T.; Chen, M. W. Highly Optimized Embedded-Atom-Method Potentials for Fourteen FCC Metals Phys. Rev. B 2011, 83, 134118
-
(2011)
Phys. Rev. B
, vol.83
, pp. 134118
-
-
Sheng, H.W.1
Kramer, M.J.2
Cadien, A.3
Fujita, T.4
Chen, M.W.5
-
39
-
-
0001538909
-
Canonical Dynamics: Equilibrium Phase-space Distributions
-
Hoover, W. G. Canonical Dynamics: Equilibrium Phase-space Distributions Phys. Rev. A 1985, 31, 1695-1697
-
(1985)
Phys. Rev. A
, vol.31
, pp. 1695-1697
-
-
Hoover, W.G.1
-
40
-
-
80052256169
-
Structural Analysis of Pd-Cu-Si Metallic Glassy Alloy Thin Films with Varying Glass Transition Temperature
-
Kajita, S.; Kohara, S.; Onodera, Y.; Fukunaga, T.; Matsubara, E. Structural Analysis of Pd-Cu-Si Metallic Glassy Alloy Thin Films with Varying Glass Transition Temperature Mater. Trans. 2011, 52, 1349-1355
-
(2011)
Mater. Trans.
, vol.52
, pp. 1349-1355
-
-
Kajita, S.1
Kohara, S.2
Onodera, Y.3
Fukunaga, T.4
Matsubara, E.5
-
41
-
-
4243943295
-
Generalized Gradient Approximation Made Simple
-
Perdew, J. P.; Burke, K.; Ernzerhof, M. Generalized Gradient Approximation Made Simple Phys. Rev. Lett. 1996, 77, 3865-3868
-
(1996)
Phys. Rev. Lett.
, vol.77
, pp. 3865-3868
-
-
Perdew, J.P.1
Burke, K.2
Ernzerhof, M.3
-
42
-
-
85026334466
-
Perdew, Burke, and Ernzerhof Reply
-
Perdew, J. P.; Burke, K.; Ernzerhof, M. Perdew, Burke, and Ernzerhof Reply Phys. Rev. Lett. 1998, 80, 891
-
(1998)
Phys. Rev. Lett.
, vol.80
, pp. 891
-
-
Perdew, J.P.1
Burke, K.2
Ernzerhof, M.3
-
43
-
-
25744460922
-
Projector Augmented-Wave Method
-
Blöchl, P. E. Projector Augmented-Wave Method Phys. Rev. B 1994, 50, 17953-17979
-
(1994)
Phys. Rev. B
, vol.50
, pp. 17953-17979
-
-
Blöchl, P.E.1
-
44
-
-
12844286241
-
Ab Initio Molecular Dynamics for Liquid Metals
-
Kresse, G.; Hafner, J. Ab Initio Molecular Dynamics for Liquid Metals Phys. Rev. B 1993, 47, 558-561(R)
-
(1993)
Phys. Rev. B
, vol.47
, pp. 558-561R
-
-
Kresse, G.1
Hafner, J.2
-
45
-
-
2442537377
-
Efficient Iterative Schemes for ab Initio Total-energy Calculations Using a Plane-wave Basis Set
-
Kresse, G.; Furthmüller, J. Efficient Iterative Schemes for ab Initio Total-energy Calculations Using a Plane-wave Basis Set Phys. Rev. B 1996, 54, 11169-11186
-
(1996)
Phys. Rev. B
, vol.54
, pp. 11169-11186
-
-
Kresse, G.1
Furthmüller, J.2
-
46
-
-
1842816907
-
Special Points for Brillouin-zone Integrations
-
Monkhorst, H. J.; Pack, J. D. Special Points for Brillouin-zone Integrations Phys. Rev. B 1976, 13, 5188-5192
-
(1976)
Phys. Rev. B
, vol.13
, pp. 5188-5192
-
-
Monkhorst, H.J.1
Pack, J.D.2
-
47
-
-
79958222239
-
Catalytic Activity of Pd/Cu Random Alloy Nanoparticles for Oxygen Reduction
-
Tang, W. J.; Zhang, L.; Henkelman, G. Catalytic Activity of Pd/Cu Random Alloy Nanoparticles for Oxygen Reduction J. Phys. Chem. Lett. 2011, 2, 1328-1331
-
(2011)
J. Phys. Chem. Lett.
, vol.2
, pp. 1328-1331
-
-
Tang, W.J.1
Zhang, L.2
Henkelman, G.3
-
48
-
-
36449003554
-
Constant Pressure Molecular Dynamics Algorithms
-
Martyna, G.; Tobias, D.; Klein, M. Constant Pressure Molecular Dynamics Algorithms J. Chem. Phys. 1994, 101, 4177-4189
-
(1994)
J. Chem. Phys.
, vol.101
, pp. 4177-4189
-
-
Martyna, G.1
Tobias, D.2
Klein, M.3
-
49
-
-
33646236900
-
A Liouville-operator Derived Measure-preserving Integrator for Molecular Dynamics Simulations in the Isothermal-isobaric Ensemble
-
Tuckerman, M.; Alejandre, J.; López-Rendón, R.; Jochim, A.; Martyna, G. A Liouville-operator Derived Measure-preserving Integrator for Molecular Dynamics Simulations in the Isothermal-isobaric Ensemble J. Phys. A: Math. Gen. 2006, 39, 5629-5651
-
(2006)
J. Phys. A: Math. Gen.
, vol.39
, pp. 5629-5651
-
-
Tuckerman, M.1
Alejandre, J.2
López-Rendón, R.3
Jochim, A.4
Martyna, G.5
|