Table A.1
Summary of atomic and molecular collisional data in BASECOL2012.
Id | Target | Collider | Levels | Temperature (K) | Method | Method’s Ref | PES Ref | Year | Recom | Fit | Matched |
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101 | C | H | f3 | 5–1000 | CC | 2 | 75 | 2007 | yes | y | n |
116 | C | H | f3 | 4–1000 | CC | 1 | 74 | 1977 | no | y | n |
106 | C | o-H2 | f3 | 10–1200 | CC | 3 | 3 | 1991 | yes | y | n |
105 | C | p-H2 | f3 | 10–1200 | CC | 3 | 3 | 1991 | yes | y | n |
104 | C | He | f3 | 10–150 | CC | 4 | 4 | 1991 | yes | y | n |
102 | C+ | H | f2 | 20–2000 | CC | 5 | 76 | 2005 | yes | y | n |
145 | C3 | He | r6 | 5–15 | CC | 6 | 6 | 2008 | yes | n | n |
214 | C4 | He | r20f30 | 1–50 | CC | 122 | 122 | 2010 | yes | n | n |
201 | C2H | He | h34 | 5–100 | CC+recoup | 104 | 104 | 2012 | yes | n | n |
192 | CH+ | He | r11 | 20–200 | CC | 7 | 7 | 2008 | no | n | y |
146 | CH+ | He | r11 | 20–2000 | CC | 77 | 7 | 2009 | yes | n | y |
191 | CH+ | He | r6 | 1–200 | CC | 78 | 78 | 2010 | yes | n | y |
160 | CH+ | e | r8 | 100–15 000 | R | 8 | 8 | 1999 | yes | y | y |
224 | A-CH3OH | He | r256, vt = 0 | 10–200 | CS | 125 | 126 | 2010 | yes | n | n |
226 | A-CH3OH | He | r256, vt = 1 | 10–200 | CS | 125 | 126 | 2010 | yes | n | n |
229 | A-CH3OH | He | r256, vt = 2 | 10–200 | CS | 125 | 126 | 2010 | yes | n | n |
225 | E-CH3OH | He | r256, vt = 0 | 10–200 | CS | 125 | 126 | 2010 | yes | n | n |
227 | E-CH3OH | He | r256, vt = 1 | 10–200 | CS | 125 | 126 | 2010 | yes | n | n |
228 | E-CH3OH | He | r256, vt = 2 | 10–200 | CS | 125 | 126 | 2010 | yes | n | n |
230 | A-CH3OH | p-H2 | r256, vt = 0 | 10–200 | CS | 127 | 128 | 2010 | yes | n | n |
231 | A-CH3OH | p-H2 | r256, vt = 1 | 10–200 | CS | 127 | 128 | 2010 | yes | n | n |
232 | A-CH3OH | p-H2 | r256, vt = 2 | 10–200 | CS | 127 | 128 | 2010 | yes | n | n |
233 | E-CH3OH | p-H2 | r256, vt = 0 | 10–200 | CS | 127 | 128 | 2010 | yes | n | n |
234 | E-CH3OH | p-H2 | r256, vt = 1 | 10–200 | CS | 127 | 128 | 2010 | yes | n | n |
235 | E-CH3OH | p-H2 | r256, vt = 2 | 10–200 | CS | 127 | 128 | 2010 | yes | n | n |
222 | A-CH3OH | He | rvt150 | 10–400 | CS | 129 | 126 | 2011 | yes | n | n |
223 | E-CH3OH | He | rvt150 | 10–400 | CS | 129 | 126 | 2011 | yes | n | n |
46 | o c-C3H2 | He | r47 | 30–120 | IOS | 9, 79 | 79 | 2000 | yes | y | y |
47 | p c-C3H2 | He | r48 | 30–120 | IOS | 9, 79 | 79 | 2000 | yes | y | y |
210 | CN− | p-H2 | r11 | 5–100 | CS | 118 | 118 | 2011 | yes | n | y |
211 | CN− | o-H2 | r11 | 5–100 | CS | 118 | 118 | 2011 | yes | n | y |
209 | CN | He | r21f41 | 5–350 | CC | 119 | 119 | 2010 | yes | n | n |
212 | CN | He | r13h73 | 5–30 | CC+recoupl | 120 | 119 | 2011 | yes | n | n |
213 | CN | p-H2 | r6h37 | 5–100 | CC+recoupl | 121 | 121 | 2012 | yes | n | n |
48 | CO | H | r8 | 5–100 | CC | 10 | 80 | 2002 | yes | y | y |
60 | CO | H | r17 | 100–3000 | CC | 10 | 80 | 2002 | yes | y | y |
49 | CO | H | v5 | 100–3000 | IOS | 10 | 80 | 2002 | yes | y | n |
218 | CO | o-H2 | r41 | 1–3000 | CC/CS | 123 | 81 | 2010 | yes | y | y |
219 | CO | p-H2 | r41 | 1–3000 | CC/CS | 123 | 81 | 2010 | yes | y | y |
97 | CO | o-H2 | r6 | 5–70 | CC/CS | 11 | 81 | 2006 | no | y | y |
98 | CO | p-H2 | r6 | 5–70 | CC/CS | 11 | 81 | 2006 | no | y | y |
33 | CO | o-H2 | r20 | 5–400 | CC | 12 | 82 | 2001 | no | y | y |
34 | CO | p-H2 | r29 | 5–400 | CC | 12 | 82 | 2001 | no | y | y |
50 | CO | He | r15 | 5–500 | CC | 14 | 83 | 2002 | yes | n | y |
51 | CO | He | v7 | 500–5000 | IOS | 14 | 83 | 2002 | yes | n | n |
161 | CO+ | e | r5 | 100–10 000 | R | 15 | 15 | 2001 | yes | y | n |
61 | CS | p-H2 | r13 | 10–100 | CC/CS | 16 | 16 | 1978 | no | y | y |
10 | CS | p-H2 | r21 | 20–300 | CC/CS | 17 | 16 | 1992 | yes | y | y |
90 | CS | He | r31 | 10-300 | CC | 18 | 18 | 2006 | yes | n | y |
121 | CS | He | v3 (r38 in each v) | 300-1500 | VCC-IOS | 19 | 19 | 2007 | yes | n | y |
54 | o-H2 | H | r3 | 100–1000 | CC | 20 | 84 | 1997 | yes | y | n |
53 | p-H2 | H | r3 | 100–1000 | CC | 20 | 84 | 1997 | yes | y | n |
26 | o-H2 | H | v1r8,v2r7,v3r5,v4r4 (up to l25) | 100–6000 | CC | 21 | 84 | 1998 | yes | y | n |
27 | p-H2 | H | v1r9,v2r7,v3r6,v4r5 (up to l28) | 100–6000 | CC | 21 | 84 | 1998 | yes | y | n |
28 | o-H2 | o-H2 | v1r7,v2r6,v3r4 (up to l22) | 100–6000 | CC | 21 | 85 | 1999 | yes | y | n |
30 | p-H2 | o-H2 | v1r8,v2r6,v3r5 (up to l19) | 100–6000 | CC | 21 | 85 | 1999 | yes | y | n |
29 | o-H2 | p-H2 | v1r13,v2r11,v3r5 (up to l24) | 100–6000 | CC | 23 | 85 | 1998 | yes | y | n |
31 | p-H2 | p-H2 | v1r9,v2r7,v3r6,v4r5 (up to l28) | 100–6000 | CC | 23 | 85 | 1998 | yes | y | n |
24 | o-H2 | He | v1r8,v2r7,v3r5,v4r4 (up to l25) | 100–6000 | CC | 24 | 86 | 1998 | yes | y | n |
25 | p-H2 | He | v1r9,v2r7,v3r6,v4r5 (up to l28) | 100–6000 | CC | 24 | 86 | 1998 | yes | y | n |
165 | o-H2+ | e | r2 | 100–10 000 | R | 15 | 15 | 2001 | yes | y | n |
166 | p-H2+ | e | r2 | 100–10 000 | R | 15 | 15 | 2001 | yes | y | n |
178 | H2+ | e | v3 | 100–20 000 | R | 13 | 13 | 1993 | yes | y | n |
168 | o-H3+ | e | r2 | 100–10 000 | R | 25 | 25 | 2003 | no | y | n |
167 | p-H3+ | e | r4 | 100–10 000 | R | 25 | 25 | 2003 | no | y | n |
240 | o-H3+ | e | r7 | 5–2000 | MQDT | 131 | 131 | 2010 | yes | n | n |
241 | p-H3+ | e | r13 | 5–2000 | MQDT | 131 | 131 | 2010 | yes | n | n |
170 | o-H3O+ | e | r4 | 100–10 000 | R | 25 | 25 | 2003 | yes | y | n |
169 | p-H3O+ | e | r8 | 100–10 000 | R | 25 | 25 | 2003 | yes | y | n |
18 | o-H2CO | He | r41 | 10–300 | CC/CS | 25 | 87 | 1991 | yes | y | y |
17 | p-H2CO | He | r40 | 10–300 | CC/CS | 25 | 87 | 1991 | yes | y | y |
198 | o-H2CO | p-H2 | r10 | 5–100 | CC/CS | 102 | 102 | 2009 | yes | y | n |
199 | o-H2CO | o-H2 | r10 | 5–100 | CC/CS | 102 | 102 | 2009 | yes | y | n |
41 | o-H2O | o-H2 | r5 | 20–140 | CC/CS | 27 | 88 | 1996 | no | y | y |
42 | o-H2O | p-H2 | r5 | 20–140 | CC/CS | 27 | 88 | 1996 | no | y | y |
43 | p-H2O | o-H2 | r5 | 20–140 | CC/CS | 27 | 88 | 1996 | no | y | y |
44 | p-H2O | p-H2 | r5 | 20–140 | CC/CS | 27 | 88 | 1996 | no | y | y |
190 | o-H2O | o-H2 | r45 | 20–2000 | QCT | 28 | 89 | 2007 | no | n | n |
189 | o-H2O | p-H2 | r45 | 20–2000 | QCT | 28 | 89 | 2007 | no | n | n |
188 | p-H2O | o-H2 | r45 | 20–2000 | QCT | 28 | 89 | 2007 | no | n | n |
187 | p-H2O | p-H2 | r45 | 20–2000 | QCT | 28 | 89 | 2007 | no | n | n |
127 | o-H2O | p-H2 | r45 | 5–1500 | CC | 29 | 89 | 2009 | yes | y | y |
193 | o-H2O | o-H2 | r45 | 5–1500 | CC | 91 | 89 | 2011 | yes | y | y |
194 | p-H2O | p-H2 | r45 | 5–1500 | CC | 91 | 89 | 2011 | yes | y | y |
195 | p-H2O | o-H2 | r45 | 5–1500 | CC | 90, 91 | 89 | 2010, 2011 | yes | y | y |
4 | o-H2O | He | r45 | 20–2000 | CC/CS | 31 | 90 | 1993 | yes | y | y |
22 | p-H2O | He | r45 | 20–2000 | CC/CS | 31 | 90 | 1993 | yes | y | y |
134 | o-H2O | e | r14 | 100–8000 | R | 32 | 32 | 2004 | yes | y | n |
128 | p-H2O | e | r14 | 100–8000 | R | 32 | 32 | 2004 | yes | y | n |
182 | o-H2O | H2 | rv411 | 200–5000 | QCT + approx | 30 | 89 | 2008 | yes | n | n |
181 | p-H2O | H2 | rv411 | 200–5000 | QCT + approx | 30 | 89 | 2008 | yes | n | n |
184 | o-H2O | e | rv411 | 200–5000 | R + approx | 30 | 32 | 2008 | yes | n | n |
183 | p-H2O | e | rv411 | 200–5000 | R + approx | 30 | 32 | 2008 | yes | n | n |
140 | o-D2O | e | r18 | 100–8000 | R | 32 | 32 | 2004 | yes | y | n |
135 | p-D2O | e | r18 | 100–8000 | R | 32 | 32 | 2004 | yes | y | n |
207 | o-D2O | p-H2 | r6 | 5–100 | CC | 111 | 89 | 2012 | yes | n | n |
215 | p-D2O | p-H2 | r6 | 5–100 | CC | 111 | 89 | 2012 | yes | n | n |
216 | HDO | p-H2 | r30 | 5–300 | CC/CS | 111 | 89 | 2012 | yes | n | n |
217 | HDO | o-H2 | r30 | 5–300 | CC/CS | 111 | 89 | 2012 | yes | n | n |
36 | HC3N | He | r21 | 10–80 | QCT/IOS | 16 | 16 | 1978 | no | n | y |
175 | HC3N | He | r11 | 10–20 | CC | 33 | 33 | 2007 | yes | n | y |
174 | HC3N | p-H2 | r51 | 10–100 | CC/CS/QCT | 33 | 33 | 2007 | yes ? | y | y |
13 | HCl | He | r8 | 10–300 | CC/CS | 34 | 34 | 1994 | yes | n | n |
14 | HCl | He | h28 | 10–300 | CC/CS/hIOS | 34 | 34 | 1994 | yes | n | y |
62 | HCN | He | r8 | 5–100 | CC | 35 | 35 | 1974 | no | y | y |
202 | HCN | He | r26 | 5–500 | CC | 107, 108 | 109 | 2010 | yes | y | y |
203 | HNC | He | r26 | 5–500 | CC | 107, 108 | 108 | 2010 | yes | y | y |
238 | HNC | p-H2 | r11 | 5–100 | CC | 130 | 130 | 2011 | yes | y | y |
239 | HNC | o-H2 | r11 | 5–100 | CC | 130 | 130 | 2011 | yes | y | y |
92 | HCN | He | r4h13 | 10–30 | CC | 36 | 35 | 1986 | no | y | y |
204 | HCN | p-H2 | r10h31 | 5–100 | CC+recoup | 110 | 110 | 2012 | yes | n | n |
147 | HCN | e | r9 | 5–2000 | R+Born | 37 | 37 | 2007 | yes | y | y |
153 | HCN | e | r3h10 | 10–100–1000 | R+Born +hIOS | 37 | 37 | 2007 | yes | n | n |
150 | HNC | e | r9 | 5–2000 | R+Born | 37 | 37 | 2007 | yes | y | y |
155 | HNC | e | r3h10 | 10–1000 | R+Born+hIOS | 37 | 37 | 2007 | yes | y | n |
157 | DCN | e | r9 | 5–2000 | R+Born | 37 | 37 | 2007 | yes | y | y |
154 | DCN | e | r3h10 | 10–100–1000 | R+Born+hIOS | 37 | 37 | 2007 | yes | y | n |
151 | DNC | e | r9 | 5–2000 | R+Born | 37 | 37 | 2007 | yes | y | y |
154 | DNC | e | r3h10 | 10–100–1000 | R+Born+hIOS | 37 | 37 | 2007 | yes | y | n |
11 | HCO+ | p-H2 | r21 | 5–390 | CC | 43 | 91 | 1999 | yes | y | y |
163 | HCO+ | e | r3 | 100–10 000 | R+Born | 15 | 15 | 2001 | yes | y | y |
144 | HCP | p-H2 | r11 | 10–70 | CC | 38 | 38 | 2008 | yes | n | y |
143 | HCP | He | r16 | 20–200 | CC | 39 | 39 | 2008 | yes | n | y |
19 | HCS+ | He | r11 | 10–60 | CC/CS | 40 | 40 | 1984 | yes | n | y |
70 | HD | H | r9 | 100–2000 | CC | 41 | 84 | 1999 | yes | n | n |
71 | HD | H | v2r9 | 100–2080 | CC | 124 | 84 | 1999 | yes | n | n |
72 | HD | He | r10 | 80–1000 | CC | 44 | 86 | 1999 | yes | n | n |
73 | HD | o-H2 | r9 | 50–500 | CC | 42 | 85 | 1999 | yes | y | n |
74 | HD | p-H2 | r9 | 50–500 | CC | 42 | 85 | 1999 | yes | y | n |
75 | HD | o-H2 | v2r9 | 100–2080 | CC | 124 | 85 | 1999 | yes | n | n |
76 | HD | p-H2 | v2r9 | 100–2080 | CC | 124 | 85 | 1999 | yes | n | n |
21 | HDO | He | r34 | 50–500 | CC/CS | 45 | 92 | 1989 | yes | y | y |
141 | HDO | e | r36 (a-type) | 100–8000 | R | 32 | 32 | 2004 | yes | y | n |
142 | HDO | e | r36 (b-type) | 100–8000 | R | 32 | 32 | 2004 | yes | y | n |
63 | HF | He | r10 | 0.1–300 | CC | 46 | 93 | 2005 | yes | n | y |
176 | HeH+ | e | r3 | 100–20 000 | R | 48 | 48 | 1998 | yes | y | y |
177 | HeH+ | e | v3 | 100–20 000 | R | 48 | 48 | 1998 | yes | y | n |
122 | HOCO+ | He | r25 | 10–30 | CS | 47 | 47 | 2007 | yes | n | y |
208 | NH | He | r8f25 | 5– 350 | CC | 73 | 103 | 2011 | yes | n | n |
91 | N2H+ | He | r7 | 5–40 | CC | 49 | 49 | 1975 | no | y | y |
82 | N2H+ | He | r7 | 5–50 | CC | 50 | 94 | 2005 | yes | n | y |
69 | N2H+ | He | r7h55 | 5–50 | CC+S–recoup | 50 | 94 | 2005 | yes | n | y |
125 | o-ND2H | He | r9 | 5–100 | CS | 51 | 51, 95 | 2007 | yes | n | y |
126 | p-ND2H | He | r9 | 5–100 | CS | yes | 51, 95 | 2007 | yes | n | n |
124 | o-NH2D | He | r9 | 5–100 | CS | 52 | 52, 95 | 2006 | yes | n | y |
123 | p-NH2D | He | r9 | 5–100 | CS | 52 | 52, 95 | 2006 | yes | n | n |
85 | o-NH3 | p-H2 | r9 | 15–300 | CC | 53 | 53 | 1986 | no | n | y |
87 | p-NH3 | p-H2 | r16 | 15–300 | CC | 56 | 53 | 1987 | no | y | y |
88 | o-NH3 | p-H2 | r17 | 15–300 | CC | 54 | 53 | 1988 | yes | n | y |
89 | p-NH3 | p-H2 | r24 | 15–300 | CC | 54 | 53 | 1988 | yes | n | y |
196 | o-NH3 | p-H2 | r6 | 5–100 | CC | 101 | 101 | 2009 | yes | n | n |
197 | p-NH3 | p-H2 | r16 | 5–100 | CC | 101 | 101 | 2009 | yes | n | n |
83 | o-NH3 | He | r22 | 5–300 | CC | 55 | 95 | 2005 | yes | n | y |
84 | p-NH3 | He | r16 | 5–300 | CC | 55 | 95 | 2005 | yes | y | y |
185 | NO | He | f98 | 10–500 | CS | 61 | 100 | 2008 | yes | n | n |
164 | NO+ | e | r5 | 100–5000 | R | 15 | 15 | 2001 | yes | y | y |
117 | O | H | f3 | 50–1000 | CC | 1 | 1 | 1977 | no | y | n |
107 | O | H | f3 | 50–1000 | CC | 2 | 96 | 2007 | yes | y | n |
109 | O | o-H2 | f3 | 20–1500 | CC | 57 | 57 | 1992 | yes | y | n |
108 | O | p-H2 | f3 | 20–1500 | CC | 57 | 57 | 1992 | yes | y | n |
35 | OCS | p-H2 | r13 | 10–100 | CS | 16 | 16 | 1978 | yes | y | y |
12 | OCS | He | r27 | 10–150 | CC | 58 | 97 | 2001 | yes | y | y |
206 | OH | He | f46 | 5–350 | CC | 116 | 117 | 2007 | yes | n | n |
205 | O2 | He | r23f36 | 5–350 | CC | 112 | 113 | 2010 | yes | n | n |
118 | PN | He | r31 | 5–300 | CC/CS | 59 | 59 | 2007 | yes | n | n |
103 | Si+ | H | f2 | 20–2000 | CC | 5 | 5 | 2005 | yes | y | n |
179 | SiH+ | He | r11 | 5–200 | CC | 60 | 60 | 2009 | yes | n | n |
45 | o-SiC2 | He | r40 | 25–125 | IOS | 9, 98 | 98 | 2000 | yes | y | y |
23 | SiO | p-H2 | r21 | 20–300 | CS | 17 | 17 | 1992 | no | y | y |
100 | SiO | p-H2 | r27 | 10–300 | CC | 62 | 62 | 2006 | yes | n | y |
95 | SiO | He | r27 | 10–300 | CC | 62 | 62 | 2006 | yes | n | y |
186 | SiO | e | r41 | 5-5000 | R | 63 | 63 | 2009 | yes | y | n |
172 | SiS | o-H2 | r41 | 5–300 | CS | 64 | 64 | 2008 | yes | n | y |
171 | SiS | p-H2 | r41 | 5–300 | CS | 64 | 64 | 2008 | yes | n | y |
119 | SiS | He | r26 | 5–200 | CC | 65 | 65 | 2007 | yes | n | y |
173 | SiS | He | v5r100 | 100–1500 | VCC+IOS | 66 | 66 | 2008 | yes | n | n |
200 | SH | He | f58 | 5–350 | CC | 114 | 115 | 2009 | yes | n | n |
32 | SO | p-H2 | r24f70 | 50–350 | rCS+fIOS | 67 | 67 | 1994 | no | n | y |
180 | SO | p-H2 | r31 | 5–50 | CC | 68 | 68 | 2007 | yes | n | n |
96 | SO | He | rv236 | 300–800 | VCC–IOS | 69 | 69 | 2006 | yes | n | n |
81 | SO | He | f91 | 60–300 | CC/IOS | 70 | 71 | 2006 | yes | y | y |
77 | SO | He | f31 | 5–50 | CC | 71 | 71 | 2005 | yes | n | y |
20 | SO2 | He | r50 | 25–125 | IOS | 72 | 99 | 1995 | no | y | y |
220 | SO2 | p-H2 | r31 | 5–30 | CC | 105 | 106 | 2011 | yes | n | n |
221 | SO2 | o-H2 | r31 | 5–30 | CC | 105 | 106 | 2011 | yes | n | n |
Notes.The “Method” notations CC, CS, IOS, QCT are explained in the text, “R” stands for R-matrix calculations, “born” stands for Born and Born-Coulomb approximations, VCC-IOS means that vibration is treated with CC and rotation with IOS, hIOS means that the hyperfine transitions are treated with IOS, “approx” means that some additional approximation has been performed, “recoupl” means that a recoupling technique for T or S matrices has been used to obtain the hyperfine cross sections. The different columns provide the following information: (1:) ID by which the collisional system can be found directly in the database, (2:) the available atomic or molecular target, (3:) the perturbing collider, (4:) the rovibrational levels for which rate coefficients are available: the symbols r, f, v, rv and h are used to denote rotational, fine, vibrational, ro-vibrational and hyperfine transitions respectively (for example, “r7” means that rate coefficients are available for the 7 lowest rotational levels), (5:) temperature range for which the rates have been calculated, (6:) method employed to treat the collision dynamics, (7,8:) references to the papers describing the calculations and the potential energy surfaces calculations respectively, (10:) whether the set is recommended, (11:) whether fitting coefficients are available, and the last column indicates whether the collisional set is matched with spectroscopic data (see Sect. 2.2.5).
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