Atomic and molecular electron affinities: photoelectron experiments and theoretical computations JC Rienstra-Kiracofe, GS Tschumper, HF Schaefer, S Nandi, GB Ellison Chemical reviews 102 (1), 231-282, 2002 | 1438 | 2002 |
Anchoring the water dimer potential energy surface with explicitly correlated computations and focal point analyses GS Tschumper, ML Leininger, BC Hoffman, EF Valeev, HF Schaefer III, ... The Journal of chemical physics 116 (2), 690-701, 2002 | 309 | 2002 |
CCSD (T) Complete Basis Set Limit Relative Energies for Low-Lying Water Hexamer Structures DM Bates, GS Tschumper The Journal of Physical Chemistry A 113 (15), 3555-3559, 2009 | 238 | 2009 |
Infrared cavity ringdown spectroscopy of methanol clusters: Single donor hydrogen bonding RA Provencal, JB Paul, K Roth, C Chapo, RN Casaes, RJ Saykally, ... The Journal of chemical physics 110 (9), 4258-4267, 1999 | 167 | 1999 |
Hydrogen bonding in alcohol clusters: A comparative study by infrared cavity ringdown laser absorption spectroscopy RA Provencal, RN Casaes, K Roth, JB Paul, CN Chapo, RJ Saykally, ... The Journal of Physical Chemistry A 104 (7), 1423-1429, 2000 | 141 | 2000 |
Predicting electron affinities with density functional theory: Some positive results for negative ions GS Tschumper, HF Schaefer III The Journal of chemical physics 107 (7), 2529-2541, 1997 | 129 | 1997 |
Epigenetic modification, dehydration, and molecular crowding effects on the thermodynamics of i-motif structure formation from C-rich DNA YP Bhavsar-Jog, E Van Dornshuld, TA Brooks, GS Tschumper, ... Biochemistry 53 (10), 1586-1594, 2014 | 112 | 2014 |
Ab Initio Studies of π⊙⊙⊙ π Interactions: The Effects of Quadruple Excitations BW Hopkins, GS Tschumper The Journal of Physical Chemistry A 108 (15), 2941-2948, 2004 | 109 | 2004 |
Indolizine‐Based Donors as Organic Sensitizer Components for Dye‐Sensitized Solar Cells AJ Huckaba, F Giordano, LE McNamara, KM Dreux, NI Hammer, ... Advanced Energy Materials 5 (7), 1401629, 2015 | 100 | 2015 |
Interstaple Dithiol Cross-Linking in Au25 (SR) 18 Nanomolecules: A Combined Mass Spectrometric and Computational Study VR Jupally, R Kota, EV Dornshuld, DL Mattern, GS Tschumper, D Jiang, ... Journal of the American Chemical Society 133 (50), 20258-20266, 2011 | 91 | 2011 |
Structures, thermochemistry, and electron affinities of the PFn and PF− n series, n= 1–6 GS Tschumper, JT Fermann, HF Schaefer III The Journal of chemical physics 104 (10), 3676-3683, 1996 | 84 | 1996 |
Development of a 3-body: many-body integrated fragmentation method for weakly bound clusters and application to water clusters (H2O) n= 3− 10, 16, 17 DM Bates, JR Smith, T Janowski, GS Tschumper The Journal of chemical physics 135 (4), 2011 | 83 | 2011 |
Anchoring the potential energy surface of the cyclic water trimer JA Anderson, K Crager, L Fedoroff, GS Tschumper The Journal of chemical physics 121 (22), 11023-11029, 2004 | 82 | 2004 |
Real versus artifactual symmetry-breaking effects in Hartree–Fock, density-functional, and coupled-cluster methods NJ Russ, TD Crawford, GS Tschumper The Journal of chemical physics 120 (16), 7298-7306, 2004 | 82 | 2004 |
Benchmark structures and harmonic vibrational frequencies near the CCSD (T) complete basis set limit for small water clusters:(H2O) n= 2, 3, 4, 5, 6 JC Howard, GS Tschumper Journal of chemical theory and computation 11 (5), 2126-2136, 2015 | 81 | 2015 |
Multicentered integrated QM: QM methods for weakly bound clusters: An efficient and accurate 2-body: many-body treatment of hydrogen bonding and van der Waals interactions GS Tschumper Chemical physics letters 427 (1-3), 185-191, 2006 | 78 | 2006 |
A multicentered approach to integrated QM/QM calculations. Applications to multiply hydrogen bonded systems BW Hopkins, GS Tschumper Journal of computational chemistry 24 (13), 1563-1568, 2003 | 76 | 2003 |
Intrinsic conformational preferences of substituted cyclohexanes and tetrahydropyrans evaluated at the CCSD (T) complete basis set limit: implications for the anomeric effect AJ Weldon, TL Vickrey, GS Tschumper The Journal of Physical Chemistry A 109 (48), 11073-11079, 2005 | 74 | 2005 |
Getting down to the Fundamentals of Hydrogen Bonding: Anharmonic Vibrational Frequencies of (HF) 2 and (H2O) 2 from Ab Initio Electronic Structure Computations JC Howard, JL Gray, AJ Hardwick, LT Nguyen, GS Tschumper Journal of Chemical Theory and Computation 10 (12), 5426-5435, 2014 | 71 | 2014 |
Effects of Hydrogen Bonding on Vibrational Normal Modes of Pyrimidine AA Howard, GS Tschumper, NI Hammer The Journal of Physical Chemistry A 114 (25), 6803-6810, 2010 | 70 | 2010 |