-
1
-
-
0142042522
-
-
Pankow JF, Luo WT. Bender DA, Isabelle LM, Hollingsworth JS, Chen C, Asher WE, Zogorski JS (2003) Atmos Environ 37:5023
-
(2003)
Atmos Environ
, vol.37
, pp. 5023
-
-
Pankow, J.F.1
Luo, W.T.2
Bender, D.A.3
Isabelle, L.M.4
Hollingsworth, J.S.5
Chen, C.6
Asher, W.E.7
Zogorski, J.S.8
-
8
-
-
0034326279
-
-
Amonette JE, Workman DJ, Kenedy DW, Fruchter JS, Gorby YA (2000) Environ Sci Technol 34:4606
-
(2000)
Environ Sci Technol
, vol.34
, pp. 4606
-
-
Amonette, J.E.1
Workman, D.J.2
Kenedy, D.W.3
Fruchter, J.S.4
Gorby, Y.A.5
-
13
-
-
0036813559
-
-
Gaspar D, Lea A. Engelhard M, Baer D. Miehr R, Tratnyek P (2002) Langmuir 18:7688
-
(2002)
Langmuir
, vol.18
, pp. 7688
-
-
Gaspar, D.1
Lea, A.2
Engelhard, M.3
Baer, D.4
Miehr, R.5
Tratnyek, P.6
-
19
-
-
0017556592
-
-
Wolfe NL, Zepp RG, Paris DF, Baughman GL, Hollis RC (1977) Environ Sci Technol 11:1077
-
(1977)
Environ Sci Technol
, vol.11
, pp. 1077
-
-
Wolfe, N.L.1
Zepp, R.G.2
Paris, D.F.3
Baughman, G.L.4
Hollis, R.C.5
-
21
-
-
0035899757
-
-
Borisov YA, Arcia EE, Mielke SL, Garrett BC, Dunning JTH (2001) J Phys Chem A 105:7724
-
(2001)
J Phys Chem A
, vol.105
, pp. 7724
-
-
Borisov, Y.A.1
Arcia, E.E.2
Mielke, S.L.3
Garrett, B.C.4
Dunning, J.T.H.5
-
22
-
-
3142700672
-
-
Bylaska EJ, Dixon DA, Felmy AR, Apra E, Windus TL, Zhan CG, Tratnyek PG (2004) J Phys Chem A 108:5883
-
(2004)
J Phys Chem A
, vol.108
, pp. 5883
-
-
Bylaska, E.J.1
Dixon, D.A.2
Felmy, A.R.3
Apra, E.4
Windus, T.L.5
Zhan, C.G.6
Tratnyek, P.G.7
-
44
-
-
0031268580
-
-
Kumaran S, Su M, Lim K, Michael J, Klippenstein S, DiFelice J, Mudipalli P, Kiefer J, Dixon D, Peterson K (1997) J Phys Chem A 101:8653
-
(1997)
J Phys Chem A
, vol.101
, pp. 8653
-
-
Kumaran, S.1
Su, M.2
Lim, K.3
Michael, J.4
Klippenstein, S.5
DiFelice, J.6
Mudipalli, P.7
Kiefer, J.8
Dixon, D.9
Peterson, K.10
-
60
-
-
0012154673
-
-
Curtiss LA, Raghavachari K, Redfern PC, Rassolov V, Pople JA (1998) J Chem Phys 109:7764
-
(1998)
J Chem Phys
, vol.109
, pp. 7764
-
-
Curtiss, L.A.1
Raghavachari, K.2
Redfern, P.C.3
Rassolov, V.4
Pople, J.A.5
-
64
-
-
0242338386
-
-
Pacific Northwest National Laboratory, Richland, Washington 99352-0999, USA
-
Straatsma TP, Apra E, Windus TL, Dupuis M, Bylaska EJ, de Jong W, Hirata S, Smith DMA, Hackler MT, Pollack L, Harrison RJ, Nieplocha J, Tipparaju V, Krishnan M, Brown E, Cisneros G, Fann GI, Fruchtl H, Garza J, Hirao K, Kendall R, Nichols JA, Tsemekhman K, Valiev M, Wolinski K, Anchell J, Bernholdt D, Borowski P, Clark T, Clerc D, Dachsel H, Deegan M, Dyall K, Elwood D, Glendening E, Gutowski M, Hess A, Jaffe J, Johnson B, Ju J, R. Kobayashi R, Kutteh R, Lin Z, Littlefield R, Long X, Meng B, Nakajima T, Niu S, Rosing M, Sandrone G, Stave M, Taylor H, Thomas G, van Lenthe J, Wong A. Zhang Z (2003) NWChem, A computational chemistry package for parallel computers. Pacific Northwest National Laboratory, Richland, Washington 99352-0999, USA
-
(2003)
NWChem, A Computational Chemistry Package for Parallel Computers
-
-
Straatsma, T.P.1
Apra, E.2
Windus, T.L.3
Dupuis, M.4
Bylaska, E.J.5
De Jong, W.6
Hirata, S.7
Smith, D.M.A.8
Hackler, M.T.9
Pollack, L.10
Harrison, R.J.11
Nieplocha, J.12
Tipparaju, V.13
Krishnan, M.14
Brown, E.15
Cisneros, G.16
Fann, G.I.17
Fruchtl, H.18
Garza, J.19
Hirao, K.20
Kendall, R.21
Nichols, J.A.22
Tsemekhman, K.23
Valiev, M.24
Wolinski, K.25
Anchell, J.26
Bernholdt, D.27
Borowski, P.28
Clark, T.29
Clerc, D.30
Dachsel, H.31
Deegan, M.32
Dyall, K.33
Elwood, D.34
Glendening, E.35
Gutowski, M.36
Hess, A.37
Jaffe, J.38
Johnson, B.39
Ju, J.R.40
Kobayashi, R.41
Kutteh, R.42
Lin, Z.43
Littlefield, R.44
Long, X.45
Meng, B.46
Nakajima, T.47
Niu, S.48
Rosing, M.49
Sandrone, G.50
Stave, M.51
Taylor, H.52
Thomas, G.53
Van Lenthe, J.54
Wong, A.55
Zhang, Z.56
more..
-
65
-
-
84881454506
-
-
Gaussian, Pittsburgh, PA
-
Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Chesesman JR, Zakrzewski VG, Montgomery J, J. A., Stratmann RE, Burant JC, Dapprich S, Millam JM, Daniels AD, Kudin KN, Strain MC, Farkas O, Tomasi J, Barone V, Cossi M, Cammi R, Mennucci B, Pomelli C, Adamo C, Clifford S, Ochterski J, A. PG, Ayala PY, Cui Q, Morokuma K, Malick DK, Rabuck AD, Raghavachari K, Foresman JB, Cioslowski J, Ortiz JV, Stefanov BB, Liu G, Liashenko A, Piskorz P, Komaromi I, Gomperts R, Martin RL, Fox DJ, T. K, Al-Laham MA, Peng CY, Nanayakkara A, Gonzalez C, Challacombe M, Gill PMW, Johnson B, Chen W, Wong MW, Andres JL, Gonzalez C, Head-Gordon M, Replogle ES, Pople JA (1998) Gaussian 98, Revision A.4, Gaussian, Pittsburgh, PA
-
(1998)
Gaussian 98, Revision A.4
-
-
Frisch, M.J.1
Trucks, G.W.2
Schlegel, H.B.3
Scuseria, G.E.4
Robb, M.A.5
Chesesman, J.R.6
Zakrzewski, V.G.7
Montgomery, J.8
A, J.9
Stratmann, R.E.10
Burant, J.C.11
Dapprich, S.12
Millam, J.M.13
Daniels, A.D.14
Kudin, K.N.15
Strain, M.C.16
Farkas, O.17
Tomasi, J.18
Barone, V.19
Cossi, M.20
Cammi, R.21
Mennucci, B.22
Pomelli, C.23
Adamo, C.24
Clifford, S.25
Ochterski, J.26
A, P.G.27
Ayala, P.Y.28
Cui, Q.29
Morokuma, K.30
Malick, D.K.31
Rabuck, A.D.32
Raghavachari, K.33
Foresman, J.B.34
Cioslowski, J.35
Ortiz, J.V.36
Stefanov, B.B.37
Liu, G.38
Liashenko, A.39
Piskorz, P.40
Komaromi, I.41
Gomperts, R.42
Martin, R.L.43
Fox, D.J.44
K, T.45
Al-Laham, M.A.46
Peng, C.Y.47
Nanayakkara, A.48
Gonzalez, C.49
Challacombe, M.50
Gill, P.M.W.51
Johnson, B.52
Chen, W.53
Wong, M.W.54
Andres, J.L.55
Gonzalez, C.56
Head-Gordon, M.57
Replogle, E.S.58
Pople, J.A.59
more..
-
68
-
-
0004255576
-
-
University Science Books, Sausalito, CA
-
McQuarrie DA (1983) Quantum chemistry. University Science Books, Sausalito, CA
-
(1983)
Quantum Chemistry
-
-
McQuarrie, D.A.1
-
76
-
-
0010922509
-
-
Orozco M, Alhambra C, Barril X, Lopez JM, Busquest MA, Luque FJ (1996) J Mol Model 2:1
-
(1996)
J Mol Model
, vol.2
, pp. 1
-
-
Orozco, M.1
Alhambra, C.2
Barril, X.3
Lopez, J.M.4
Busquest, M.A.5
Luque, F.J.6
-
78
-
-
84962369875
-
Continuum solvation models: Classical and quantum mechanical implementations
-
Lipkowitz KB, Boyd DB (ed) VCH, New York
-
Cramer CJ, Truhlar DG (1995) Continuum solvation models: classical and quantum mechanical implementations. In: Lipkowitz KB, Boyd DB (ed) Reviews in Computational Chemistry 6, VCH, New York, p 1
-
(1995)
Reviews in Computational Chemistry
, vol.6
, pp. 1
-
-
Cramer, C.J.1
Truhlar, D.G.2
-
79
-
-
0002537828
-
Continuum solvation models
-
Tapia O, Bertran J (ed) Kluwer, Dordrecht
-
Cramer CJ, Truhlar DG (1996) Continuum solvation models. In: Tapia O, Bertran J (ed) Solvent effects and chemical reactivity, Kluwer, Dordrecht, p 1
-
(1996)
Solvent Effects and Chemical Reactivity
, pp. 1
-
-
Cramer, C.J.1
Truhlar, D.G.2
-
89
-
-
0000301294
-
-
Tissandier MD, Cowen KA, Feng WY, Gundlach E, Cohen MH, Earhart AD, Coe JV, Tuttle TR Jr. (1998) J Phys Chem A 102:7787
-
(1998)
J Phys Chem A
, vol.102
, pp. 7787
-
-
Tissandier, M.D.1
Cowen, K.A.2
Feng, W.Y.3
Gundlach, E.4
Cohen, M.H.5
Earhart, A.D.6
Coe, J.V.7
Tuttle Jr., T.R.8
-
115
-
-
0002026088
-
Henry's law constant for compounds in water
-
Yaws CL (ed) Gulf Publishing Company, Houston, TX
-
Yaws CL, Yang H-C (1992) Henry's law constant for compounds in water. In: Yaws CL (ed) Thermodynamic and physical property data, Gulf Publishing Company, Houston, TX, p 181
-
(1992)
Thermodynamic and Physical Property Data
, pp. 181
-
-
Yaws, C.L.1
Yang, H.-C.2
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