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David C. Langreth - Publications

Affiliations: 
Rutgers University, New Brunswick, New Brunswick, NJ, United States 
Area:
Condensed Matter Physics
Website:
https://www.physics.rutgers.edu/grad/prizes/langreth_award.html
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71 high-probability publications. We are testing a new system for linking publications to authors. You can help! If you notice any inaccuracies, please sign in and mark papers as correct or incorrect matches. If you identify any major omissions or other inaccuracies in the publication list, please let us know.

Year Citation  Score
2019 Zhang ZY, Langreth DC. Electronic damping of adsorbate fundamental and overtone vibrations at metal surfaces. Physical Review. B, Condensed Matter. 39: 10028-10046. PMID 9947781 DOI: 10.1103/Physrevb.39.10028  0.333
2012 Lee K, Kolb B, Thonhauser T, Vanderbilt D, Langreth DC. Structure and energetics of a ferroelectric organic crystal of phenazine and chloranilic acid Physical Review B - Condensed Matter and Materials Physics. 86. DOI: 10.1103/Physrevb.86.104102  0.342
2012 Yao Y, Nijem N, Li J, Chabal YJ, Langreth DC, Thonhauser T. Analyzing the frequency shift of physiadsorbed CO 2 in metal organic framework materials Physical Review B - Condensed Matter and Materials Physics. 85. DOI: 10.1103/Physrevb.85.064302  0.32
2011 Nijem N, Thissen P, Yao Y, Longo RC, Roodenko K, Wu H, Zhao Y, Cho K, Li J, Langreth DC, Chabal YJ. Understanding the preferential adsorption of CO2 over N2 in a flexible metal-organic framework. Journal of the American Chemical Society. 133: 12849-57. PMID 21736366 DOI: 10.1021/Ja2051149  0.347
2011 Berland K, Chakarova-Käck SD, Cooper VR, Langreth DC, Schröder E. A van der Waals density functional study of adenine on graphene: single-molecular adsorption and overlayer binding. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 23: 135001. PMID 21403239 DOI: 10.1088/0953-8984/23/13/135001  0.319
2011 Lee K, Kelkkanen AK, Berland K, Andersson S, Langreth DC, Schröder E, Lundqvist BI, Hyldgaard P. Evaluation of a density functional with account of van der Waals forces using experimental data of H2 physisorption on Cu(111) Physical Review B - Condensed Matter and Materials Physics. 84. DOI: 10.1103/Physrevb.84.193408  0.396
2011 Yanagisawa S, Hamada I, Lee K, Langreth DC, Morikawa Y. Adsorption of Alq3on Mg(001) surface: Role of chemical bonding, molecular distortion, and van der Waals interaction Physical Review B. 83. DOI: 10.1103/Physrevb.83.235412  0.312
2011 Kong L, Chabal YJ, Langreth DC. First-principles approach to rotational-vibrational frequencies and infrared intensity for H2 adsorbed in nanoporous materials Physical Review B - Condensed Matter and Materials Physics. 83. DOI: 10.1103/Physrevb.83.121402  0.379
2010 Nijem N, Veyan JF, Kong L, Wu H, Zhao Y, Li J, Langreth DC, Chabal YJ. Molecular hydrogen "pairing" interaction in a metal organic framework system with unsaturated metal centers (MOF-74). Journal of the American Chemical Society. 132: 14834-48. PMID 20925338 DOI: 10.1021/Ja104923F  0.347
2010 Langreth DC, Lundqvist BI. Comment on "Nonlocal van der waals density functional made simple". Physical Review Letters. 104: 099303; author reply. PMID 20367018 DOI: 10.1103/Physrevlett.104.099303  0.371
2010 Nijem N, Veyan JF, Kong L, Li K, Pramanik S, Zhao Y, Li J, Langreth D, Chabal YJ. Interaction of molecular hydrogen with microporous metal organic framework materials at room temperature. Journal of the American Chemical Society. 132: 1654-64. PMID 20070080 DOI: 10.1021/Ja908817N  0.332
2010 Lee K, Murray ED, Kong L, Lundqvist BI, Langreth DC. Higher-accuracy van der Waals density functional Physical Review B - Condensed Matter and Materials Physics. 82. DOI: 10.1103/Physrevb.82.081101  0.424
2010 Cooper VR, Kong L, Langreth DC. Computing dispersion interactions in density functional theory Physics Procedia. 3: 1417-1430. DOI: 10.1016/J.Phpro.2010.01.201  0.41
2009 Murray ÉD, Lee K, Langreth DC. Investigation of Exchange Energy Density Functional Accuracy for Interacting Molecules. Journal of Chemical Theory and Computation. 5: 2754-62. PMID 26631788 DOI: 10.1021/Ct900365Q  0.433
2009 Langreth DC, Lundqvist BI, Chakarova-Käck SD, Cooper VR, Dion M, Hyldgaard P, Kelkkanen A, Kleis J, Kong L, Li S, Moses PG, Murray E, Puzder A, Rydberg H, Schröder E, et al. A density functional for sparse matter. Journal of Physics. Condensed Matter : An Institute of Physics Journal. 21: 084203. PMID 21817355 DOI: 10.1088/0953-8984/21/8/084203  0.624
2009 Kong L, Román-Pérez G, Soler JM, Langreth DC. Energetics and dynamics of H(2) adsorbed in a nanoporous material at low temperature. Physical Review Letters. 103: 096103. PMID 19792810 DOI: 10.1103/Physrevlett.103.096103  0.37
2009 Lan A, Li K, Wu H, Kong L, Nijem N, Olson DH, Emge TJ, Chabal YJ, Langreth DC, Hong M, Li J. RPM3: a multifunctional microporous MOF with recyclable framework and high H2 binding energy. Inorganic Chemistry. 48: 7165-73. PMID 19722690 DOI: 10.1021/Ic9002115  0.35
2009 Li S, Cooper VR, Thonhauser T, Lundqvist BI, Langreth DC. Stacking interactions and DNA intercalation. The Journal of Physical Chemistry. B. 113: 11166-72. PMID 19719266 DOI: 10.1021/Jp905765C  0.32
2009 Kong L, Cooper VR, Nijem N, Li K, Li J, Chabal YJ, Langreth DC. Theoretical and experimental analysis of H2 binding in a prototypical metal-organic framework material Physical Review B - Condensed Matter and Materials Physics. 79. DOI: 10.1103/Physrevb.79.081407  0.348
2008 Li S, Cooper VR, Thonhauser T, Puzder A, Langreth DC. A density functional theory study of the benzene-water complex. The Journal of Physical Chemistry. A. 112: 9031-6. PMID 18729422 DOI: 10.1021/Jp801693P  0.359
2008 Cooper VR, Thonhauser T, Langreth DC. An application of the van der Waals density functional: Hydrogen bonding and stacking interactions between nucleobases. The Journal of Chemical Physics. 128: 204102. PMID 18513005 DOI: 10.1063/1.2924133  0.383
2008 Hooper J, Cooper VR, Thonhauser T, Romero NA, Zerilli F, Langreth DC. Predicting C-H/pi interactions with nonlocal density functional theory. Chemphyschem : a European Journal of Chemical Physics and Physical Chemistry. 9: 891-5. PMID 18383059 DOI: 10.1002/Cphc.200700715  0.389
2007 Thonhauser T, Cooper VR, Li S, Puzder A, Hyldgaard P, Langreth DC. Van der Waals density functional: Self-consistent potential and the nature of the van der Waals bond Physical Review B - Condensed Matter and Materials Physics. 76. DOI: 10.1103/Physrevb.76.125112  0.408
2007 Kleis J, Lundqvist BI, Langreth DC, Schröder E. Towards a working density-functional theory for polymers: First-principles determination of the polyethylene crystal structure Physical Review B - Condensed Matter and Materials Physics. 76. DOI: 10.1103/Physrevb.76.100201  0.382
2006 Chakarova-Käck SD, Schröder E, Lundqvist BI, Langreth DC. Application of van der Waals density functional to an extended system: adsorption of benzene and naphthalene on graphite. Physical Review Letters. 96: 146107. PMID 16712103 DOI: 10.1103/Physrevlett.96.146107  0.437
2006 Thonhauser T, Puzder A, Langreth DC. Interaction energies of monosubstituted benzene dimers via nonlocal density functional theory. The Journal of Chemical Physics. 124: 164106. PMID 16674128 DOI: 10.1063/1.2189230  0.43
2006 Puzder A, Dion M, Langreth DC. Binding energies in benzene dimers: Nonlocal density functional calculations. The Journal of Chemical Physics. 124: 164105. PMID 16674127 DOI: 10.1063/1.2189229  0.645
2005 Dion M, Rydberg H, Schröder E, Langreth DC, Lundqvist BI. Erratum: Van der Waals Density Functional for General Geometries [Phys. Rev. Lett.92, 246401 (2004)] Physical Review Letters. 95. DOI: 10.1103/Physrevlett.95.109902  0.394
2005 Langreth DC, Dion M, Rydberg H, Schröder E, Hyldgaard P, Lundqvist BI. Van der Waals density functional theory with applications International Journal of Quantum Chemistry. 101: 599-610. DOI: 10.1002/Qua.20315  0.386
2004 Dion M, Rydberg H, Schröder E, Langreth DC, Lundqvist BI. van der Waals density functional for general geometries. Physical Review Letters. 92: 246401. PMID 15245113 DOI: 10.1103/Physrevlett.92.246401  0.635
2003 Rydberg H, Dion M, Jacobson N, Schröder E, Hyldgaard P, Simak SI, Langreth DC, Lundqvist BI. Van der Waals density functional for layered structures. Physical Review Letters. 91: 126402. PMID 14525379 DOI: 10.1103/Physrevlett.91.126402  0.64
2003 Rydberg H, Jacobson N, Hyldgaard P, Simak SI, Lundqvist BI, Langreth DC. Hard numbers on soft matter Surface Science. 532: 606-610. DOI: 10.1016/S0039-6028(03)00109-2  0.398
2001 Lundqvist BI, Bogicevic A, Carling K, Dudiy SV, Gao S, Hartford J, Hyldgaard P, Jacobson N, Langreth DC, Lorente N, Ovesson S, Razaznejad B, Ruberto C, Rydberg H, Schröder E, et al. Density-functional bridge between surfaces and interfaces Surface Science. 493: 253-270. DOI: 10.1016/S0039-6028(01)01225-0  0.337
2000 Rydberg H, Lundqvist BI, Langreth DC, Dion M. Tractable nonlocal correlation density functionals for flat surfaces and slabs Physical Review B - Condensed Matter and Materials Physics. 62: 6997-7006. DOI: 10.1103/Physrevb.62.6997  0.656
1999 Plihal M, Langreth DC. Electronic Friction In The Presence Of Strong Intra-Atomic Correlations For Atoms Moving Near Metal Surfaces Physical Review B. 60: 5969-5980. DOI: 10.1103/Physrevb.60.5969  0.34
1999 Gumhalter B, Langreth DC. Unified model of diffractive and multiphonon He atom scattering from adsorbates: Holstein renormalization of the interactions and the complete Debye-Waller factor Physical Review B. 60: 2789-2809. DOI: 10.1103/Physrevb.60.2789  0.303
1999 Hult E, Rydberg H, Lundqvist BI, Langreth DC. Unified treatment of asymptotic van der Waals forces Physical Review B - Condensed Matter and Materials Physics. 59: 4708-4713. DOI: 10.1103/Physrevb.59.4708  0.431
1999 Plihal M, Langreth DC, Nordlander P. Effect of parallel velocity on the formation of a Kondo resonance in the atom-surface interaction Physical Review B. 59: 13322-13327. DOI: 10.1103/Physrevb.59.13322  0.322
1998 Plihal M, Langreth DC. Role Of Intra-Adsorbate Coulomb Correlations In Energy Transfer At Metal Surfaces Physical Review B. 58: 2191-2206. DOI: 10.1103/Physrevb.58.2191  0.332
1998 Lundqvist BI, Hult E, Rydberg H, Bogicevic A, Strömquist J, Langreth DC. Density functionals and van der Waals interactions at surfaces Progress in Surface Science. 59: 149-165. DOI: 10.1016/S0079-6816(98)00042-2  0.452
1998 Gao S, Langreth DC. Image state mediated electron transfer at surfaces Surface Science. 398: L314-L319. DOI: 10.1016/S0039-6028(98)80033-2  0.309
1998 Plihal M, Langreth DC. Energy transfer between open-shell species and metal surfaces Surface Science. 395: L252-L255. DOI: 10.1016/S0039-6028(97)00853-4  0.376
1998 Andersson Y, Hult E, Apell P, Langreth DC, Lundqvist BI. Density-functional account of van der Waals forces between parallel surfaces Solid State Communications. 106: 235-238. DOI: 10.1016/S0038-1098(98)00080-5  0.427
1997 Brunner T, Langreth DC. Dynamic charge susceptibility for the infinite-U Anderson model Physical Review B. 55: 2578-2593. DOI: 10.1103/Physrevb.55.2578  0.364
1997 Li Y, Langreth DC, Pederson MR. Surface Structure Of Mgo (001) : Ab Initio Versus Shell Model Physical Review B. 55: 16456-16465. DOI: 10.1103/Physrevb.55.16456  0.304
1996 Shao H, Nordlander P, Langreth DC. Probing the Highly Correlated Mixed-Valent State via Charge Transfer with Atoms Moving Out from a Surface. Physical Review Letters. 77: 948-951. PMID 10062947 DOI: 10.1103/Physrevlett.77.948  0.34
1996 Hult E, Andersson Y, Lundqvist BI, Langreth DC. Density Functional for van der Waals Forces at Surfaces. Physical Review Letters. 77: 2029-2032. PMID 10061839 DOI: 10.1103/Physrevlett.77.2029  0.373
1995 Shao H, Nordlander P, Langreth DC. Nonadiabatic effects in charge transfer in atom-surface scattering. Physical Review. B, Condensed Matter. 52: 2988-2994. PMID 9981372 DOI: 10.1103/Physrevb.52.2988  0.351
1995 Shao H, Nordlander P, Langreth DC. Non-adiabatic effects in charge transfer caused by electron correlation Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions With Materials and Atoms. 100: 260-266. DOI: 10.1016/0168-583X(94)00822-1  0.354
1995 Lundqvist BI, Andersson Y, Shao H, Chan S, Langreth DC. Density functional theory including Van Der Waals forces International Journal of Quantum Chemistry. 56: 247-255. DOI: 10.1002/Qua.560560410  0.434
1994 Burke K, Perdew JP, Langreth DC. Is the local density approximation exact for short wavelength fluctuations? Physical Review Letters. 73: 1283-1286. PMID 10057671 DOI: 10.1103/Physrevlett.73.1283  0.321
1994 Shao H, Langreth DC, Nordlander P. Theoretical description of quasiresonant charge exchange in atom-surface collisions. Physical Review B. 49: 13948-13965. PMID 10010343 DOI: 10.1103/Physrevb.49.13948  0.332
1994 Shao H, Langreth DC, Nordlander P. Many-body theory for charge transfer in atom-surface collisions. Physical Review B. 49: 13929-13947. PMID 10010342 DOI: 10.1103/Physrevb.49.13929  0.377
1994 Gumhalter B, Kieron B, Langreth DC. Evolution operator and energy spectrum of a quasiclassical particle interacting with bosons: Application to atom-surface scattering Surface Review and Letters. 1: 133-156. DOI: 10.1142/S0218625X94000163  0.34
1993 Nordlander P, Shao H, Langreth DC. Intra-atomic correlation effects in charge transfer Nuclear Instruments and Methods in Physics Research Section B: Beam Interactions With Materials and Atoms. 78: 11-19. DOI: 10.1016/0168-583X(93)95770-6  0.331
1990 Zhang ZY, Langreth DC, Perdew JP. Planar-surface charge densities and energies beyond the local-density approximation. Physical Review. B, Condensed Matter. 41: 5674-5684. PMID 9994450 DOI: 10.1103/Physrevb.41.5674  0.363
1990 Langreth DC, Vosko SH. Response Functions and Nonlocal Approximations Advances in Quantum Chemistry. 21: 175-199. DOI: 10.1016/S0065-3276(08)60597-3  0.374
1990 Lou L, Langreth DC, Nordlander P. Vibrational properties of hydrogen chemisorbed on W(001) and Mo(001) Surface Science. 234: 412-420. DOI: 10.1016/0039-6028(90)90573-Q  0.349
1987 Langreth DC, Vosko SH. Exact electron-gas response functions at high density. Physical Review Letters. 59: 497-500. PMID 10035784 DOI: 10.1103/Physrevlett.59.497  0.316
1986 Hu CD, Langreth DC. Beyond the random-phase approximation in nonlocal-density-functional theory. Physical Review B. 33: 943-959. PMID 9938357 DOI: 10.1103/Physrevb.33.943  0.343
1984 Langreth DC. New Theoretical Support for Density-Functional Theory as Commonly Applied Physical Review Letters. 52: 2317-2320. DOI: 10.1103/Physrevlett.52.2317  0.392
1983 Langreth DC, Mehl MJ. Beyond the local-density approximation in calculations of ground-state electronic properties Physical Review B. 28: 1809-1834. DOI: 10.1103/Physrevb.28.1809  0.357
1981 Langreth DC, Mehl MJ. Easily Implementable Nonlocal Exchange-Correlation Energy Functional Physical Review Letters. 47: 446-450. DOI: 10.1103/Physrevlett.47.446  0.315
1980 Langreth DC, Perdew JP. Theory of nonuniform electronic systems. I. Analysis of the gradient approximation and a generalization that works Physical Review B. 21: 5469-5493. DOI: 10.1103/Physrevb.21.5469  0.392
1979 Langreth D, Perdew J. The gradient approximation to the exchange-correlation energy functional: A generalization that works Solid State Communications. 31: 567-571. DOI: 10.1016/0038-1098(79)90254-0  0.401
1978 Monnier R, Perdew JP, Langreth DC, Wilkins JW. Change-in-self-consistent-field theory of the work function Physical Review B. 18: 656-666. DOI: 10.1103/Physrevb.18.656  0.38
1977 Langreth DC, Perdew JP. Exchange-correlation energy of a metallic surface: Wave-vector analysis Physical Review B. 15: 2884-2901. DOI: 10.1103/Physrevb.15.2884  0.312
1975 Langreth D, Perdew J. The exchange-correlation energy of a metallic surface Solid State Communications. 17: 1425-1429. DOI: 10.1016/0038-1098(75)90618-3  0.382
1973 Chang JJ, Langreth DC. Deep-hole excitations in solids. II. Plasmons and surface effects in X-ray photoemission Physical Review B. 8: 4638-4654. DOI: 10.1103/Physrevb.8.4638  0.348
1969 Langreth DC. Approximate Screening Functions in Metals Physical Review. 181: 753-762. DOI: 10.1103/Physrev.181.753  0.357
1964 Langreth DC, Kadanoff LP. Perturbation theoretic calculation of polaron mobility Physical Review. 133: A1070-A1075. DOI: 10.1103/Physrev.133.A1070  0.546
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